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STL003567
Synonyms: 3-(2,6-dichlorophenyl)-6-iodo-2-[(E)-2-phenylethenyl]quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccccc1)c1c(Cl)cccc1Cl

STL003568
Synonyms: 9-(3-methoxyphenyl)-1,7-dimethyl-3-(3-methylbenzyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cccc(c1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cccc(c1)C

STL003569
Synonyms: N-{[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]carbamothioyl}thiophene-2-carboxamide
Smiles: CCCC(=O)N1CCN(CC1)c1ccc(cc1Cl)NC(=S)NC(=O)c1cccs1

STL003570
Synonyms: N-{2-[2-(4-bromophenyl)-4-hydroxy-5-oxo-3-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]ethyl}acetamide
Smiles: CC(=O)NCCN1C(c2ccc(cc2)Br)C(=C(C1=O)O)C(=O)c1ccccc1

STL003571
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(diethylamino)phenyl]methylidene}-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1N)CC

STL003572
Synonyms: N'-[(E)-(4-fluorophenyl)methylidene]-2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1C)N/N=C/c1ccc(cc1)F

STL003573
Synonyms: 1-(3,4-dimethoxyphenyl)-N-(4-methylbenzyl)-9H-beta-carboline-3-carboxamide
Smiles: COc1cc(ccc1OC)c1nc(cc2c1[nH]c1c2cccc1)C(=O)NCc1ccc(cc1)C

STL003574
Synonyms: 1-[4-(4-fluorophenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]ethanone
Smiles: Fc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)C)c1ccccc1

STL003576
Synonyms: 3-(2-chloro-6-fluorobenzyl)-9-(4-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1c(F)cccc1Cl

STL003577
Synonyms: N-(2,4-dimethylphenyl)-N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-3,4,5-trimethoxybenzamide
Smiles: COc1c(OC)cc(cc1OC)C(=O)N(c1ccc(cc1C)C)Cc1cc2ccc(cc2nc1O)C

STL003578
Synonyms: 5-[2-(7-ethyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)hydrazinylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCn1c(NN=C2C(=O)NC(=O)NC2=O)nc2c1c(=O)[nH]c(=O)n2C

STL003579
Synonyms: 1,3-dimethyl-7-(naphthalen-1-ylmethyl)-8-(piperidin-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n(Cc1cccc3c1cccc3)c(n2)CN1CCCCC1

STL003580
Synonyms: 5,7-dimethyl-2-[4-(prop-2-en-1-yloxy)phenyl]-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Smiles: C=CCOc1ccc(cc1)C1N2CC3(CN1CC(C2)(C3)C)C

STL003581
Synonyms: 3-(2-chlorobenzyl)-1,7-dimethyl-9-(3-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1cccc(c1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1Cl

STL003582
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-chlorophenyl)-N'-[(1E)-1-(3,4-dichlorophenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1c1ccccc1Cl)c1nonc1N)/c1ccc(c(c1)Cl)Cl

STL003583
Synonyms: 3-[4-methoxy-3-(piperidin-1-ylsulfonyl)phenyl]-6-methyl[1,2,4]triazolo[3,4-a]phthalazine
Smiles: COc1ccc(cc1S(=O)(=O)N1CCCCC1)c1nnc2n1nc(C)c1c2cccc1

STL003584
Synonyms: N-(4-ethoxyphenyl)-N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-3-methoxybenzamide
Smiles: CCOc1ccc(cc1)N(C(=O)c1cccc(c1)OC)Cc1cc2cccc(c2nc1O)C

STL003585
Synonyms: 3-(3-ethylphenyl)-5-methyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-ylacetate
Smiles: CCc1cccc(c1)n1cc(c2c1nc(C)n1c2nc2c1cccc2)OC(=O)C

STL003586
Synonyms: N-[(1-{N-[(4-methylphenyl)sulfonyl]-L-valyl}piperidin-4-yl)carbonyl]glycylglycine
Smiles: O=C(NCC(=O)O)CNC(=O)C1CCN(CC1)C(=O)[C@H](C(C)C)NS(=O)(=O)c1ccc(cc1)C

STL003588
Synonyms: 6-bromo-3-(2-methylprop-2-en-1-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one
Smiles: CC(=C)Cn1c(SCC(=O)c2ccccc2)nc2c(c1=O)cc(cc2)Br

STL003589
Synonyms: N'-[(E)-(2,4-dimethoxyphenyl)methylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2OC)OC)nc2c(c1=O)cccc2

STL003590
Synonyms: N-[2-(1H-indol-2-yl)ethyl]-2-({[(3E,8xi,9xi,14xi,17xi)-20-oxopregn-4-en-3-ylidene]amino}oxy)acetamide
Smiles: O=C(NCCc1cc2c([nH]1)cccc2)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2C(=O)C)C)C

STL003591
Synonyms: (5Z)-2-{[4-chloro-2-(trifluoromethyl)phenyl]amino}-5-[4-(prop-2-en-1-yloxy)benzylidene]-1,3-thiazol-4(5H)-one
Smiles: C=CCOc1ccc(cc1)/C=C/1\SC(=NC1=O)Nc1ccc(cc1C(F)(F)F)Cl

STL003592
Synonyms: (4Z)-4-(3,5-dibromo-4-ethoxybenzylidene)-2-methyl-1,3-oxazol-5(4H)-one
Smiles: CCOc1c(Br)cc(cc1Br)/C=C/1\N=C(OC1=O)C

STL003593
Synonyms: (1S,3aR)-1-acetyl-2-(2-ethoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Smiles: CCOc1ccccc1C1[C@@H](C(=O)C)N2[C@@H](C1(C#N)C#N)C=Cc1c2cccc1

STL003594
Synonyms: (5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Cc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccccc1

STL003595
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-bromophenyl)methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)Br)C

STL003596
Synonyms: 2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N'-[(1Z)-1-(4-hydroxyphenyl)propylidene]acetohydrazide
Smiles: CC/C(=N/NC(=O)CSc1nnc(s1)SCc1ccccc1)/c1ccc(cc1)O

STL003597
Synonyms: 8-[2-(dimethylamino)ethoxy]-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN(CCOc1nc2c(n1Cc1cccc3c1cccc3)c(=O)n(c(=O)n2C)C)C

STL003598
Synonyms: 5-(4-fluorophenyl)-3-(2-methylpropyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl4-fluorobenzoate
Smiles: Fc1ccc(cc1)C(=O)Oc1cn(c2c1c1nc3c(n1c(n2)c1ccc(cc1)F)cccc3)CC(C)C

STL003599
Synonyms: 6-(2-chlorophenyl)-7-(2-fluorophenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nn2c(n1)NC1=C(C2c2ccccc2F)C(Oc2c1cccc2)c1ccccc1Cl

STL003600
Synonyms: N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-N-(4-methoxyphenyl)propanamide
Smiles: CCC(=O)N(c1ccc(cc1)OC)Cc1cc2cccc(c2nc1O)C

STL003601
Synonyms: (4E)-4-{[5-(4-bromophenyl)furan-2-yl]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Brc1ccc(cc1)c1ccc(o1)/C=C/1\C(=NNC1=O)C

STL003602
Synonyms: 7-(4-chlorobenzyl)-1,3-dimethyl-8-[(2E)-2-(3-methylcyclohexylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCC/C(=N\Nc2nc3c(n2Cc2ccc(cc2)Cl)c(=O)n(c(=O)n3C)C)/C1

STL003603
Synonyms: 10a-[(E)-2-(3-methoxy-4-propoxyphenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: CCCOc1ccc(cc1OC)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1

STL003605
Synonyms: (5Z)-5-[(piperidin-1-ylamino)methylidene]-1-(2,4,6-trimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1cc(C)c(c(c1)C)N1C(=O)NC(=O)/C(=C/NN2CCCCC2)/C1=O

STL003606
Synonyms: N'-[(E)-(2-bromophenyl)methylidene]-2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1ccccc1Br

STL003607
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-naphthalen-1-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc2c1cccc2

STL003608
Synonyms: 6-chloro-3-[5-(4-methylphenyl)-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenylquinolin-2(1H)-one
Smiles: Cc1ccc(cc1)C1CC(=NN1S(=O)(=O)C)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

STL003609
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=C\c1ccccc1)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1N

STL003610
Synonyms: N-(4-phenyl-1,3-thiazol-2-yl)acridin-9-amine
Smiles: c1ccc(cc1)c1csc(n1)Nc1c2ccccc2nc2c1cccc2

STL003611
Synonyms: N-(2-bromophenyl)-1-butyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCn1c(=O)c(C(=O)Nc2ccccc2Br)c(c2c1cccc2)O

STL003612
Synonyms: N-(2,6-dimethylphenyl)-2-{[3-(2-methylpropoxy)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetamide
Smiles: CC(COn1c(SCC(=O)Nc2c(C)cccc2C)nc2c(c1=O)cccc2)C

STL003613
Synonyms: 6-{3-[(4-bromophenyl)carbonyl]-4-hydroxy-2-(2-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}hexanoicacid
Smiles: OC(=O)CCCCCN1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)c1ccc(cc1)Br)O

STL003614
Synonyms: 7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-(4-propoxybenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C/c2ccc(cc2)OCCC)nc2c1c(=O)[nH]c(=O)n2C

STL003615
Synonyms: 1-(4-bromophenyl)-5-(4-fluorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)C1N(c2ccc(cc2)Br)C(=O)C(=C1C(=O)c1ccccc1)O

STL003616
Synonyms: 5-ethyl-3-(prop-2-en-1-yl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-ylpropanoate
Smiles: C=CCn1cc(c2c1nc(CC)n1c2nc2c1cccc2)OC(=O)CC

STL003617
Synonyms: 9-(3,4-dimethylphenyl)-1,7-dimethyl-3-(2-methylbenzyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(c2ccc(c(c2)C)C)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)Cc1ccccc1C

STL003618
Synonyms: 7-(3-bromobenzyl)-1,3-dimethyl-8-(pentylamino)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCNc1nc2c(n1Cc1cccc(c1)Br)c(=O)n(c(=O)n2C)C

STL003619
Synonyms: 4-{(E)-[2-(thiophen-2-ylacetyl)hydrazinylidene]methyl}benzoicacid
Smiles: O=C(Cc1cccs1)N/N=C/c1ccc(cc1)C(=O)O

STL003621
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}-5-propyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cn(nc1c1cccs1)c1ccccc1

STL003622
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-furan-2-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccco1

STL003623
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(3-hydroxyphenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Oc1cccc(c1)/C(=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/C

STL003624
Synonyms: 6-[(2,4-dichlorophenoxy)methyl]-3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Clc1ccc(c(c1)Cl)OCc1nn2c(s1)nnc2c1ccc(cc1Cl)Cl

STL003625
Synonyms: N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(2-methoxyphenyl)-2-methylbenzamide
Smiles: COc1ccccc1N(C(=O)c1ccccc1C)Cc1cc2cc(C)ccc2nc1O

STL003626
Synonyms: 1-(naphthalen-1-yl)-5-(2-phenylethyl)-1,3,5-triazinane-2-thione
Smiles: S=C1NCN(CN1c1cccc2c1cccc2)CCc1ccccc1

STL003627
Synonyms: 5-(4-ethoxyphenyl)-4-{[(E)-phenylmethylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1)c1nnc(n1/N=C/c1ccccc1)S

STL003628
Synonyms: 7-(4-chlorobenzyl)-8-[(dibenzylamino)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)Cn1c(CN(Cc2ccccc2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STL003629
Synonyms: 6-methoxy-4-(3-{[3-(trifluoromethyl)phenyl]amino}imidazo[1,2-a]pyridin-2-yl)isoquinolin-3-ol
Smiles: COc1ccc2c(c1)c(c(nc2)O)c1nc2n(c1Nc1cccc(c1)C(F)(F)F)cccc2

STL003630
Synonyms: 4-{[(3-cyano-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-2-yl)sulfanyl]methyl}benzoicacid
Smiles: N#Cc1cc2CCCCCCc2nc1SCc1ccc(cc1)C(=O)O

STL003631
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1ccc2c(c1)OCO2

STL003632
Synonyms: 9-(4-ethoxyphenyl)-1,7-dimethyl-3-(3-methylbutyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STL003633
Synonyms: 5-{[6-hydroxy-3-(3-methoxyphenyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl][4-methoxy-3-(pyrrolidinium-1-ylmethyl)phenyl]methyl}-3-(3-methoxyphenyl)-6-oxo-2-thioxo-1,2,3,6-tetrahydropyrimidin-4
Smiles: COc1cccc(c1)n1c(=S)[nH]c(=O)c(c1[O-])C(c1c(O)[nH]c(=S)n(c1=O)c1cccc(c1)OC)c1ccc(c(c1)C[NH+]1CCCC1)OC

STL003634
Synonyms: (5E)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-1-(4-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=S)NC(=O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C1=O

STL003635
Synonyms: 4-{[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]amino}-5-(3-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/C=C/c1ccco1)S

STL003636
Synonyms: 1-(3-chlorophenyl)-2-(3-methoxyphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole
Smiles: COc1cccc(c1)c1cn2c(n1c1cccc(c1)Cl)nc(c2c1ccccc1)c1ccccc1

STL003637
Synonyms: 1-[3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1ccccc1)C(=O)C

STL003638
Synonyms: bis(2-fluorophenyl)(2-bromophenyl)phosphoramidate
Smiles: Fc1ccccc1OP(=O)(Oc1ccccc1F)Nc1ccccc1Br

STL003639
Synonyms: 8-[(2E)-2-benzylidenehydrazinyl]-7-(2-hydroxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C/c2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STL003640
Synonyms: 4-(4-ethoxyphenyl)-2,2,5,5-tetramethyl-2,5-dihydro-1H-imidazol-1-ol3-oxide
Smiles: CCOc1ccc(cc1)C1=[N+]([O-])C(N(C1(C)C)O)(C)C

STL003641
Synonyms: ethyl5-[(3-cyanopyridin-2-yl)oxy]-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(cc2)Oc1ncccc1C#N)c1ccc(cc1)OC

STL003642
Synonyms: N-[(2-hydroxyquinolin-3-yl)methyl]-N-(4-methoxyphenyl)-3-nitrobenzamide
Smiles: COc1ccc(cc1)N(C(=O)c1cccc(c1)[N+](=O)[O-])Cc1cc2ccccc2nc1O

STL003643
Synonyms: 8-[(2E)-2-(4-hydroxy-3-methoxybenzylidene)hydrazinyl]-1,3-dimethyl-7-[(2E)-3-phenylprop-2-en-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cc(/C=N/Nc2nc3c(n2C/C=C/c2ccccc2)c(=O)n(c(=O)n3C)C)ccc1O

STL003644
Synonyms: 1-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea
Smiles: CCOc1ccc(cc1)NC(=O)Nc1nnc(s1)c1ccc(cc1)Cl

STL003645
Synonyms: N-(2,5-dimethylphenyl)-N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]butanamide
Smiles: CCCC(=O)N(c1cc(C)ccc1C)Cc1cc2cccc(c2nc1O)C

STL003647
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-ethoxyphenyl)methylidene]-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1cccs1)c1nonc1N

STL003648
Synonyms: 1,7-dimethyl-3-(3-methylbutyl)-9-(4-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC(CCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(cc1)C)C

STL003649
Synonyms: 1-(4-ethoxyphenyl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)N1C(c2ccc(c(c2)OC)O)C(=C(C1=O)O)C(=O)/C=C/c1ccccc1

STL003650
Synonyms: 1-(2-chlorophenyl)-5-{[3-(2-chlorophenyl)-6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl](4-methoxy-3-{[2-(pyridin-3-yl)piperidinium-1-yl]methyl}phenyl)methyl}-6-oxo-2-thioxo-1,2,3,6-tetrah
Smiles: COc1ccc(cc1C[NH+]1CCCCC1c1cccnc1)C(c1c(O)[nH]c(=S)n(c1=O)c1ccccc1Cl)c1c([O-])[nH]c(=S)n(c1=O)c1ccccc1Cl

STL003651
Synonyms: ethyl2-[3-{[4-(benzyloxy)-3-methylphenyl]carbonyl}-4-hydroxy-2-(3-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccc(c(c1)C)OCc1ccccc1

STL003652
Synonyms: 4-[(4-fluorophenyl)carbonyl]-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-5-[4-(propan-2-yloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(Oc1ccc(cc1)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(cc1)F)O)C

STL003654
Synonyms: 1-methyl-9-(3-methylphenyl)-3-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1cccc(c1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STL003655
Synonyms: 6-amino-4-(2-ethoxyphenyl)-3-(3-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1ccccc1C1C(=C(N)Oc2c1c(n[nH]2)c1cccc(c1)OC)C#N

STL003656
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)C(F)(F)F

STL003657
Synonyms: ethyl[9-(4-methoxyphenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Smiles: CCOC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)OC

STL003658
Synonyms: 6-(5-tert-butyl-2-hydroxyphenyl)-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: O=c1c2c(c3ccccc3)n(cc2n(c(=O)n1C)C)c1cc(ccc1O)C(C)(C)C

STL003659
Synonyms: 5-(4-tert-butylphenyl)-6-(3-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: COc1cccc(c1)n1cc2c(c1c1ccc(cc1)C(C)(C)C)c(=O)n(c(=O)n2C)C

STL003660
Synonyms: 2-({[(3E,9xi,14xi,17alpha)-17-hydroxypregn-4-en-20-yn-3-ylidene]amino}oxy)-N-(1-phenylethyl)acetamide
Smiles: CC(c1ccccc1)NC(=O)CO/N=C/1\CC[C@]2(C(=C1)CC[C@@H]1C2CC[C@]2(C1CC[C@@]2(O)C#C)C)C

STL003661
Synonyms: 2-ethoxy-4-[(E)-{[3-(3-ethoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]phenol
Smiles: CCOc1cccc(c1)c1nnc(n1/N=C/c1ccc(c(c1)OCC)O)S

STL003662
Synonyms: 2-(5-{(Z)-[1-(3-chlorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-methoxybenzyl)-1H-isoindole-1,3(2H)-dione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)NC(=S)N(C1=O)c1cccc(c1)Cl

STL003663
Synonyms: 7-(4-methoxyphenyl)-6-(4-methylphenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1)C1n2nc(nc2NC2=C1C(Oc1c2cccc1)c1ccc(cc1)C)SC

STL003664
Synonyms: 5-butyl-2-(2-chlorophenyl)-7-methyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCCCC12CN3CC(C2=O)(CN(C1)C3c1ccccc1Cl)C

STL003665
Synonyms: N-carbamimidoyl-4-{[(E)-2-cyano-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}ethenyl]amino}benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)NC(=N)N)/c1scc(n1)c1ccc(cc1)CC(C)C

STL003666
Synonyms: 4-chloro-N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-N-(4-methoxyphenyl)benzamide
Smiles: COc1ccc(cc1)N(C(=O)c1ccc(cc1)Cl)Cc1cc2cccc(c2nc1O)C

STL003667
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccc(cc2)[N+](=O)[O-])c2nonc2N)ccc1O

STL003668
Synonyms: 1-(2-bromoethyl)-3-hydroxy-5-(3-nitrophenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: BrCCN1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccccc1

STL003670
Synonyms: 7,7'-propane-1,3-diylbis[3-methyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione]
Smiles: O=c1[nH]c(=O)n(c2c1n(CCCn1c(nc3c1c(=O)[nH]c(=O)n3C)N1CCCCC1)c(n2)N1CCCCC1)C

STL003671
Synonyms: N-[2-hydroxy-3-(2-methyl-1H-benzimidazol-1-yl)propyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)CC(Cn1c(C)nc2c1cccc2)O

STL003672
Synonyms: 1,4-dimethyl-5-{(Z)-[3-(3-methylbutyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-oxo-6-(thiomorpholin-4-yl)-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCC(C)C)c(n(c1=O)C)N1CCSCC1

STL003673
Synonyms: 7-(4-chlorobenzyl)-1,3-dimethyl-8-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)Sc1nncn1C

STL003674
Synonyms: 3-(3,4-dichlorobenzyl)-9-(4-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(c(c1)Cl)Cl

STL003675
Synonyms: N-(4-ethoxyphenyl)-N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-3,4,5-trimethoxybenzamide
Smiles: CCOc1ccc(cc1)N(C(=O)c1cc(OC)c(c(c1)OC)OC)Cc1cc2ccc(cc2nc1O)C

STL003676
Synonyms: 8-[(2E)-2-(3-hydroxybenzylidene)hydrazinyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Oc1cccc(c1)/C=N/Nc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STL003677
Synonyms: 4-chloro-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(4-methoxyphenyl)benzamide
Smiles: COc1ccc(cc1)N(C(=O)c1ccc(cc1)Cl)Cc1cc2cc(C)ccc2nc1O

STL003680
Synonyms: N-{2-[3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-2-oxo-4-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]ethyl}acetamide
Smiles: COc1cc(ccc1O)C1N(CCNC(=O)C)C(=O)C(=C1C(=O)c1ccccc1)O

STL003681
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N'-[(E)-thiophen-2-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1nncn1C)c1nonc1N)N/N=C/c1cccs1

STL003683
Synonyms: 1,4-dimethyl-2-oxo-5-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-6-(thiomorpholin-4-yl)-1,2-dihydropyridine-3-carbonitrile
Smiles: CCCCCN1C(=S)S/C(=C\c2c(N3CCSCC3)n(C)c(=O)c(c2C)C#N)/C1=O

STL003684
Synonyms: 7-[(2E)-but-2-en-1-yl]-3-methyl-8-[2-(propan-2-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C=C/Cn1c(NN=C(C)C)nc2c1c(=O)[nH]c(=O)n2C

STL003685
Synonyms: 6-(3-chloro-4-methoxyphenyl)-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: COc1ccc(cc1Cl)n1cc2c(c1c1ccccc1)c(=O)n(c(=O)n2C)C

STL003686
Synonyms: 4-{[(E)-anthracen-9-ylmethylidene]amino}-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1c2ccccc2cc2c1cccc2)c1ccccn1

STL003687
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2C(C)C)c2nonc2N)cc(c1O)Br

STL003688
Synonyms: 6-(4-ethylpiperazin-1-yl)-5-{(Z)-[3-(4-methoxybenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: CCN1CCN(CC1)c1c(/C=C/2\SC(=S)N(C2=O)Cc2ccc(cc2)OC)c(C)c(c(=O)n1C)C#N

STL003689
Synonyms: ethyl2-[(chloroacetyl)amino]-4,5-dihydronaphtho[1,2-b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCl)sc2c1CCc1c2cccc1

STL003690
Synonyms: 5-(4-ethylphenyl)-2-phenyl-3-propyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCCC1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)CC)c1ccccc1

STL003691
Synonyms: 3-methyltetrahydrothiophen-3-amine1,1-dioxide
Smiles: CC1(N)CCS(=O)(=O)C1

STL003693
Synonyms: 3-hydroxy-5-(2-nitrophenyl)-4-[(4-nitrophenyl)carbonyl]-1-(1,3-thiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=C(C(N1c1nccs1)c1ccccc1[N+](=O)[O-])C(=O)c1ccc(cc1)[N+](=O)[O-])O

STL003694
Synonyms: 5-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-2-oxo-6-(piperidin-1-yl)-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)Cc2ccccc2)c(n(c1=O)C)N1CCCCC1

STL003695
Synonyms: N-(3,4-dimethylphenyl)-N-[(2-hydroxyquinolin-3-yl)methyl]-4-nitrobenzamide
Smiles: O=C(N(c1ccc(c(c1)C)C)Cc1cc2ccccc2nc1O)c1ccc(cc1)[N+](=O)[O-]

STL003698
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)O

STL003699
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(2-methoxyphenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccccc1/C(=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/C

STL003700
Synonyms: 8-benzyl-1-(benzylsulfanyl)-4-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: C=CCn1c(=O)c2c3CCN(Cc3sc2n2c1nnc2SCc1ccccc1)Cc1ccccc1

STL003701
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-chlorophenyl)-N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2Cl)c2nonc2N)cc(c1OC)OC

STL003702
Synonyms: ethyl[2-({[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-1,3-thiazol-4-yl]acetate
Smiles: CCOC(=O)Cc1csc(n1)NC(=O)CSc1nnc(n1c1ccccc1)CSc1nc(C)cc(n1)C

STL003703
Synonyms: 1-[1-hydroxy-2,5,5-trimethyl-3-oxido-4-(thiophen-2-yl)-2,5-dihydro-1H-imidazol-2-yl]ethanone
Smiles: CC(=O)C1(C)[N+](=C(C(N1O)(C)C)c1cccs1)[O-]

STL003705
Synonyms: 2-(5-amino-1H-tetrazol-1-yl)-N'-[(E)-thiophen-2-ylmethylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C/c1cccs1

STL003706
Synonyms: 3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-8-(pyrrolidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCSc1nnnn1c1ccccc1)c(n2)N1CCCC1)C

STL003707
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-bromophenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)Br

STL003708
Synonyms: ethyl5-(2-{(2E)-2-[(4-bromothiophen-2-yl)methylidene]hydrazinyl}-2-oxoethoxy)-1,2-dimethyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(OCC(=O)N/N=C/c1scc(c1)Br)cc2)C

STL003709
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-propyl-N'-{(1Z)-1-[4-(1H-tetrazol-1-yl)phenyl]ethylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C(\c1ccc(cc1)n1cnnn1)/C

STL003710
Synonyms: 5-{(Z)-[3-(2-chlorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-6-(2,6-dimethylmorpholin-4-yl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)Cc2ccccc2Cl)c(n(c1=O)C)N1CC(C)OC(C1)C

STL003711
Synonyms: 1-methyl-9-(4-methylphenyl)-3-(naphthalen-1-ylmethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cccc2c1cccc2

STL003712
Synonyms: (azepan-1-ylmethyl)2,3-dihydro-1H-inden-2-ylphosphinate
Smiles: [O-]P(=O)(C1Cc2c(C1)cccc2)CN1CCCCCC1

STL003713
Synonyms: 8-[(dibenzylamino)methyl]-1,3-dimethyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)Cn1c(CN(Cc2ccccc2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STL003714
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccc(cc2)[N+](=O)[O-])c2nonc2N)cc(c1O)OC

STL003715
Synonyms: 7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-8-[(3-methoxypropyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCCNc1nc2c(n1CC(COc1ccc(cc1)OC)O)c(=O)[nH]c(=O)n2C

STL003716
Synonyms: 6-(4-chlorophenyl)-7-(4-methylphenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nn2c(n1)NC1=C(C2c2ccc(cc2)C)C(Oc2c1cccc2)c1ccc(cc1)Cl

STL003717
Synonyms: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-dimethyl-5-(3-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Cc1cccc(c1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1ccc2c(c1)OCCO2

STL003719
Synonyms: 4-{[(E)-(4-tert-butylphenyl)methylidene]amino}-5-(2-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1ccc(cc1)C(C)(C)C)c1ccccc1Cl

STL003720
Synonyms: N-[({[(3E,9xi,14xi,17beta)-17-hydroxy-17-methylandrost-4-en-3-ylidene]amino}oxy)acetyl]methionine
Smiles: CSCCC(C(=O)O)NC(=O)CO/N=C/1\CC[C@]2(C(=C1)CC[C@@H]1C2CC[C@]2(C1CC[C@]2(C)O)C)C

STL003721
Synonyms: 1,4-dimethyl-6-(morpholin-4-yl)-2-oxo-5-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,2-dihydropyridine-3-carbonitrile
Smiles: CCCCCN1C(=S)S/C(=C\c2c(N3CCOCC3)n(C)c(=O)c(c2C)C#N)/C1=O

STL003722
Synonyms: N-(1-hydroxy-2-methylpropan-2-yl)-2-methoxy-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
Smiles: OCC(NS(=O)(=O)c1cc(ccc1OC)c1nnc2n1nc(C)c1c2cccc1)(C)C

STL003723
Synonyms: 3-(3-fluorophenyl)-5-{[1-(3-fluorophenyl)-6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl][4-methoxy-3-(piperidinium-1-ylmethyl)phenyl]methyl}-6-oxo-2-thioxo-1,2,3,6-tetrahydropyrimidin-4-ol
Smiles: COc1ccc(cc1C[NH+]1CCCCC1)C(c1c(=O)[nH]c(=S)n(c1O)c1cccc(c1)F)c1c(=O)[nH]c(=S)n(c1[O-])c1cccc(c1)F

STL003724
Synonyms: 6-(4-benzylpiperazin-1-yl)-5-{(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: COCCN1C(=S)S/C(=C\c2c(C)c(C#N)c(=O)n(c2N2CCN(CC2)Cc2ccccc2)C)/C1=O

STL003725
Synonyms: N-[2-(diethylamino)ethyl]-2-({[(3E,8xi,9xi,10xi,13xi,14xi)-17-hydroxypregn-4-en-20-yn-3-ylidene]amino}oxy)acetamide
Smiles: CCN(CCNC(=O)CO/N=C/1\CCC2(C(=C1)CCC1C2CCC2(C1CC[C@]2(O)C#C)C)C)CC

STL003726
Synonyms: 3-methyl-8-(4-methylpiperazin-1-yl)-7-(4-nitrobenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)[N+](=O)[O-])c(=O)[nH]c(=O)n2C

STL003727
Synonyms: N'-[(E)-anthracen-9-ylmethylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2c3ccccc3cc3c2cccc3)nc2c(c1=O)cccc2

STL003728
Synonyms: N,N-diethyl-2-{[4-oxo-3-(propan-2-yloxy)-3,4-dihydroquinazolin-2-yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2ccccc2c(=O)n1OC(C)C)CC

STL003729
Synonyms: 3,3'-[benzene-1,4-diylbis(oxy)]bis{1-[(3,5-dimethylphenyl)amino]propan-2-ol}
Smiles: OC(COc1ccc(cc1)OCC(CNc1cc(C)cc(c1)C)O)CNc1cc(C)cc(c1)C

STL003730
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(Br)ccc1O

STL003731
Synonyms: beta-hydroxy-3-nitro-N-[({[(3E,8xi,9xi,14xi,17xi)-20-oxopregn-4-en-3-ylidene]amino}oxy)acetyl]phenylalanine
Smiles: O=C(NC(C(c1cccc(c1)[N+](=O)[O-])O)C(=O)O)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2C(=O)C)C)C

STL003733
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-phenylmethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1ccccc1

STL003734
Synonyms: 2-[(4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]-N-(4-methoxyphenyl)propanamide
Smiles: COc1ccc(cc1)NC(=O)C(Sc1nc(C)cc(n1)O)C

STL003735
Synonyms: 3-benzyl-9-(4-ethoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1

STL003736
Synonyms: N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-2-methyl-N-phenylbenzamide
Smiles: Cc1ccc2c(c1)nc(c(c2)CN(C(=O)c1ccccc1C)c1ccccc1)O

STL003737
Synonyms: N-(3,5-dichlorophenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)Nc2cc(Cl)cc(c2)Cl)c2c(n1)c1ccccc1o2

STL003738
Synonyms: 2-{[4-amino-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Smiles: COc1cc(ccc1OC)c1nnc(n1N)SCC(=O)Nc1c(C)cccc1C

STL003739
Synonyms: (5E)-1-(4-fluorophenyl)-5-({[2-(pyrrolidin-1-yl)phenyl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C\Nc2ccccc2N2CCCC2)/C1=O

STL003740
Synonyms: 2-chloro-N-[1-(4-methoxyphenyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]benzamide
Smiles: COc1ccc(cc1)N1C(=O)NC(C1=O)(NC(=O)c1ccccc1Cl)C(F)(F)F

STL003741
Synonyms: 2-{4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiophen-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenoxy}acetamide
Smiles: NC(=O)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1cccs1)c1nonc1N

STL003743
Synonyms: 8-methyl-2-(quinolin-8-yl)-N-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-amine
Smiles: Cc1cccn2c1nc(c2Nc1cccc(c1)C(F)(F)F)c1cccc2c1nccc2

STL003744
Synonyms: 1-(4-fluorophenyl)-5-{[3-(4-fluorophenyl)-6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl][4-methoxy-3-(piperidinium-1-ylmethyl)phenyl]methyl}-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccc(cc1C[NH+]1CCCCC1)C(c1c(O)[nH]c(=O)n(c1=O)c1ccc(cc1)F)c1c([O-])[nH]c(=O)n(c1=O)c1ccc(cc1)F

STL003746
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=C\c1ccccc1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N

STL003747
Synonyms: 8-{[2-(dimethylamino)ethyl]amino}-3-methyl-7-(4-nitrobenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN(CCNc1nc2c(n1Cc1ccc(cc1)[N+](=O)[O-])c(=O)[nH]c(=O)n2C)C

STL003748
Synonyms: 2-[(E)-{[3-(2-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]-6-ethoxyphenol
Smiles: CCOc1cccc(c1O)/C=N/n1c(S)nnc1c1ccccc1Cl

STL003749
Synonyms: 4-{[(E)-(4-ethylphenyl)methylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: CCc1ccc(cc1)/C=N/n1c(S)nnc1c1cccc(c1)C

STL003751
Synonyms: 2-ethoxy-4-{(Z)-[5-imino-7-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenylbenzenesulfonate
Smiles: CCOc1cc(ccc1OS(=O)(=O)c1ccccc1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(C)C

STL003752
Synonyms: N,N-bis(2-chloroethyl)-4-(diethylsulfamoyl)benzamide
Smiles: ClCCN(C(=O)c1ccc(cc1)S(=O)(=O)N(CC)CC)CCCl

STL003753
Synonyms: (5Z)-1-(3-methoxyphenyl)-5-[(morpholin-4-ylamino)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1cccc(c1)N1C(=S)NC(=O)/C(=C/NN2CCOCC2)/C1=O

STL003754
Synonyms: 3-cyclohexyl-N-[2,4,6-trioxo-1-phenyl-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]propanamide
Smiles: O=C(NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2c1ccccc1)C(F)(F)F)CCC1CCCCC1

STL003755
Synonyms: 3-(2-chloro-6-fluorophenyl)-N-(2-methoxyphenyl)-5-methyl-1,2-oxazole-4-carboxamide
Smiles: COc1ccccc1NC(=O)c1c(C)onc1c1c(F)cccc1Cl

STL003756
Synonyms: methyl{[(1,1-dioxidotetrahydrothiophen-3-yl)(methyl)carbamothioyl]sulfanyl}acetate
Smiles: COC(=O)CSC(=S)N(C1CCS(=O)(=O)C1)C

STL003757
Synonyms: 9a-[(E)-2-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}ethenyl]-9,9-dimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: COc1cc(ccc1OCc1ccc(cc1)C)/C=C/C12NC(=O)CN1c1c(C2(C)C)cccc1

STL003758
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-N'-[(E)-(2,4,6-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(OC)cc(c1/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)OC

STL003759
Synonyms: 1,1'-[ethane-1,2-diylbis(oxyethane-2,1-diyl)]bis(3-ethylquinoxalin-2(1H)-one)
Smiles: CCc1nc2ccccc2n(c1=O)CCOCCOCCn1c(=O)c(CC)nc2c1cccc2

STL003760
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-hydroxyphenyl)ethylidene]-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Oc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1c1cccs1)c1nonc1N)/C

STL003761
Synonyms: 3-cycloheptyl-5-ethyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-ylpropanoate
Smiles: CCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CC)cccc3)C1CCCCCC1

STL003762
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-chloro-6-fluorophenyl)methylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1c(F)cccc1Cl

STL003763
Synonyms: N-(4-bromo-2-methylphenyl)-2-oxo-2-{(2E)-2-[1-(pyridin-4-yl)ethylidene]hydrazinyl}acetamide
Smiles: Brc1ccc(c(c1)C)NC(=O)C(=O)N/N=C(/c1ccncc1)\C

STL003764
Synonyms: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(4-ethoxybenzylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N

STL003765
Synonyms: 4-{[(E)-(3-bromophenyl)methylidene]amino}-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Brc1cccc(c1)/C=N/n1c(S)nnc1c1ccccn1

STL003766
Synonyms: 2-[(E)-{[3-(4-ethoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]-6-(prop-2-en-1-yl)phenol
Smiles: CCOc1ccc(cc1)c1nnc(n1/N=C/c1cccc(c1O)CC=C)S

STL003767
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-methoxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N

STL003768
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2cccs2)c2nonc2N)cc(c1O)OC

STL003769
Synonyms: N-{3-[(1E)-1-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]phenyl}acetamide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1cccc(c1)NC(=O)C)\C

STL003770
Synonyms: methyl(1,1-dioxidotetrahydrothiophen-3-yl)carbamodithioate
Smiles: CSC(=S)NC1CCS(=O)(=O)C1

STL003771
Synonyms: 7-(2,4-dichlorobenzyl)-1,3-dimethyl-8-[(2E)-2-(pyridin-2-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(c(c1)Cl)Cn1c(N/N=C/c2ccccn2)nc2c1c(=O)n(c(=O)n2C)C

STL003772
Synonyms: 9-(4-ethoxyphenyl)-1,7-dimethyl-3-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STL003773
Synonyms: 2-[(3-methoxyphenyl)amino]-3-(piperidin-1-yl)naphthalene-1,4-dione
Smiles: COc1cccc(c1)NC1=C(N2CCCCC2)C(=O)c2c(C1=O)cccc2

STL003774
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dichlorophenyl)-N'-[(1E)-1-(4-fluorophenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Fc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)/C

STL003775
Synonyms: 4-{3-[(4-chlorophenyl)carbonyl]-4-hydroxy-5-oxo-2-phenyl-2,5-dihydro-1H-pyrrol-1-yl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1)c1c(C)n(n(c1=O)c1ccccc1)C

STL003776
Synonyms: 4-butyl-7-[2-(1-butyl-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-8-methyl-2H-chromen-2-one
Smiles: CCCCC1N(CCC2(C1CCCC2)O)C(=O)COc1ccc2c(c1C)oc(=O)cc2CCCC

STL003777
Synonyms: N-[(1-{N-[(4-methylphenyl)sulfonyl]-L-alanyl}piperidin-4-yl)carbonyl]-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@@H](NS(=O)(=O)c1ccc(cc1)C)C)C

STL003778
Synonyms: 2-({[(3E,9xi,14xi,17alpha)-17-hydroxypregn-4-en-20-yn-3-ylidene]amino}oxy)-N-(4-methoxybenzyl)acetamide
Smiles: COc1ccc(cc1)CNC(=O)CO/N=C/1\CC[C@]2(C(=C1)CC[C@@H]1C2CC[C@]2(C1CC[C@@]2(O)C#C)C)C

STL003779
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(3-methoxyphenyl)ethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1)/C(=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)/C

STL003780
Synonyms: 2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N'-[(1Z)-1-(2-hydroxyphenyl)ethylidene]acetohydrazide
Smiles: O=C(N/N=C(\c1ccccc1O)/C)CSc1nnc(s1)SCc1ccccc1

STL003781
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(3-nitrophenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Clc1cccc(c1)c1nnc(n1/N=C/c1cccc(c1)[N+](=O)[O-])S

STL003782
Synonyms: 3,5-dibromo-1-{2-[4-butyl-4-(ethoxycarbonyl)-2-methyl-5-oxotetrahydrofuran-2-yl]-2-oxoethyl}pyridinium(non-preferredname)
Smiles: CCCCC1(CC(OC1=O)(C)C(=O)C[n+]1cc(Br)cc(c1)Br)C(=O)OCC

STL003783
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(4-chlorophenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(cc1)/C=N/n1c(S)nnc1c1cccc(c1)Cl

STL003784
Synonyms: 4-{(Z)-[2-(2,4-dichlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenylethylcarbonate
Smiles: CCOC(=O)Oc1ccc(cc1)/C=C/1\N=C(OC1=O)c1ccc(cc1Cl)Cl

STL003785
Synonyms: 4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiophen-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-methoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2cccs2)c2nonc2N)ccc1OC(=O)C

STL003786
Synonyms: N-[6,6-dimethyl-1-(2-methylpropyl)-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]cyclohexanecarboxamide
Smiles: CC(CN1C2=C(C(C1=O)(NC(=O)C1CCCCC1)C(F)(F)F)C(=O)CC(C2)(C)C)C

STL003787
Synonyms: 2-{[4-amino-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)acetamide
Smiles: COc1cc(cc(c1OC)OC)c1nnc(n1N)SCC(=O)Nc1ccc(c(c1)F)C

STL003789
Synonyms: methylN-1,3-benzothiazol-2-yl-2-[bis(2-methylpropoxy)phosphoryl]-3,3,3-trifluoroalaninate
Smiles: COC(=O)C(P(=O)(OCC(C)C)OCC(C)C)(C(F)(F)F)Nc1nc2c(s1)cccc2

STL003790
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-(4-methylphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)C)C

STL003792
Synonyms: 7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-8-(heptylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCSc1nc2c(n1CC(COc1ccc(cc1)Cl)O)c(=O)[nH]c(=O)n2C

STL003793
Synonyms: 9-benzyl-3-(2-chlorobenzyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Clc1ccccc1Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)Cc1ccccc1

STL003794
Synonyms: 6-amino-3-tert-butyl-4-[3-methoxy-4-(propan-2-yloxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC(C)C)c([nH]n2)C(C)(C)C

STL003795
Synonyms: 1-ethyl-1H-1,2,3-triazole-4,5-dicarboxylicacid
Smiles: CCn1nnc(c1C(=O)O)C(=O)O

STL003796
Synonyms: ethyl[9-(4-ethoxyphenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Smiles: CCOC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)OCC

STL003797
Synonyms: 1-methyl-9-(3-methylphenyl)-3-(naphthalen-1-ylmethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1cccc(c1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cccc2c1cccc2

STL003798
Synonyms: 1-[2-(4a-hydroxy-1-phenyloctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-3-methyl-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Smiles: Cc1cc(OCC(=O)N2CCC3(C(C2c2ccccc2)CCCC3)O)c2c(c1)oc(=O)c1c2CCCC1

STL003799
Synonyms: N-(3-chloro-4-methylphenyl)-2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]acetamide
Smiles: O=C(C(=O)N/N=C/c1cccnc1)Nc1ccc(c(c1)Cl)C

STL003800
Synonyms: 3-(2,5-dimethylbenzyl)-9-(4-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cc(C)ccc1C

STL003801
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-pyridin-4-ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1ccncc1

STL003802
Synonyms: 7-(4-bromobenzyl)-1,3-dimethyl-8-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)Cn1c(N/N=C/c2cccs2)nc2c1c(=O)n(c(=O)n2C)C

STL003803
Synonyms: 2-methyl-4-(naphthalen-2-ylsulfanyl)[1]benzofuro[3,2-d]pyrimidine
Smiles: Cc1nc(Sc2ccc3c(c2)cccc3)c2c(n1)c1ccccc1o2

STL003804
Synonyms: 7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-8-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)/C=N/Nc1nc2c(n1CC(COc1ccc(cc1)Cl)O)c(=O)[nH]c(=O)n2C

STL003805
Synonyms: (5E)-5-(thiophen-2-ylmethylidene)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1cccs1)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STL003809
Synonyms: (5E)-5-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}methylidene)-1-ethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=S)NC(=O)/C(=C\c2cn(c3c2cccc3)CC(=O)N2CCCCCC2)/C1=O

STL003810
Synonyms: N-(3-methoxyphenyl)-5,7-dinitroquinolin-8-amine
Smiles: COc1cccc(c1)Nc1c(cc(c2c1nccc2)[N+](=O)[O-])[N+](=O)[O-]

STL003811
Synonyms: 2-{[6-(1,3-benzodioxol-5-yl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-(1-phenylethyl)acetamide
Smiles: N#Cc1c(SCC(=O)NC(c2ccccc2)C)nc(cc1C(F)(F)F)c1ccc2c(c1)OCO2

STL003812
Synonyms: 8-(hexylsulfanyl)-3-methyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: C=CCn1c(SCCCCCC)nc2c1c(=O)[nH]c(=O)n2C

STL003813
Synonyms: 4-(3-chlorophenyl)-2,3-diphenyl-1,2,4-oxadiazolidin-5-one
Smiles: Clc1cccc(c1)N1C(=O)ON(C1c1ccccc1)c1ccccc1

STL003814
Synonyms: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(3-fluorobenzylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: Fc1cccc(c1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N

STL003815
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-leucyl]piperidin-4-yl}carbonyl)-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@@H](NC(=O)OC(C)(C)C)CC(C)C

STL003816
Synonyms: 5-(3-chloro-2-methylphenyl)-1-phenyl-3-(phenylcarbonyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Smiles: O=C(C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1C)Cl)c1ccccc1)c1ccccc1

STL003817
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-1-[(4-methylbenzyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)C)C)NC(=O)OC(C)(C)C

STL003818
Synonyms: 8-[(2E)-2-(3-hydroxybenzylidene)hydrazinyl]-7-(2-hydroxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C/c2cccc(c2)O)nc2c1c(=O)[nH]c(=O)n2C

STL003819
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN(C)C)c2nonc2N)ccc1O

STL003820
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-chlorophenyl)ethylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)Cl)\C

STL003821
Synonyms: N-{(7S)-10-[(3-chlorobenzyl)amino]-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamide
Smiles: COc1cc2CC[C@@H](c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCc1cccc(c1)Cl)NC(=O)C

STL003822
Synonyms: N'-[(E)-biphenyl-4-ylmethylidene]-2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1C)N/N=C/c1ccc(cc1)c1ccccc1

STL003823
Synonyms: 8-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: C=CCn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)c1ccc(cc1)OC

STL003824
Synonyms: 8-amino-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(N)nc2c1c(=O)[nH]c(=O)n2C

STL003825
Synonyms: N-(2,4-dimethylphenyl)-N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-4-nitrobenzamide
Smiles: Cc1ccc(c(c1)C)N(C(=O)c1ccc(cc1)[N+](=O)[O-])Cc1cc2cccc(c2nc1O)C

STL003826
Synonyms: 5-{(Z)-[3-(4-fluorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-6-(4-methylpiperidin-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)Cc2ccc(cc2)F)c(n(c1=O)C)N1CCC(CC1)C

STL003828
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(4-methylphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)C

STL003831
Synonyms: 3-hexyl-9-(3-methoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cccc(c1)OC

STL003832
Synonyms: 6'-amino-1-(2-chloro-6-fluorobenzyl)-2-oxo-3'-phenyl-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31C(=O)N(c1c3cccc1)Cc1c(F)cccc1Cl)c(n[nH]2)c1ccccc1

STL003834
Synonyms: N-(2,4-dimethoxybenzyl)-1-ethyl-1H-benzimidazol-2-amine
Smiles: COc1ccc(c(c1)OC)CNc1nc2c(n1CC)cccc2

STL003835
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(furan-2-yl)ethylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1nncn1C)c1nonc1N)N/N=C(/c1ccco1)\C

STL003837
Synonyms: 7-heptyl-3-methyl-8-(propylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(SCCC)nc2c1c(=O)[nH]c(=O)n2C

STL003838
Synonyms: 9a-{(E)-2-[3-methoxy-4-(propan-2-yloxy)phenyl]ethenyl}-9,9-dimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: COc1cc(ccc1OC(C)C)/C=C/C12NC(=O)CN1c1c(C2(C)C)cccc1

STL003840
Synonyms: (5Z)-1-(2-methoxyphenyl)-5-[(morpholin-4-ylamino)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccccc1N1C(=S)NC(=O)/C(=C/NN2CCOCC2)/C1=O

STL003841
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-fluorophenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Fc1cccc(c1)/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N

STL003842
Synonyms: 1-phenyl-1H-tetrazol-5-yl(1E)-N-(2-nitrophenyl)-2-oxopropanehydrazonothioate
Smiles: CC(=O)/C(=N\Nc1ccccc1[N+](=O)[O-])/Sc1nnnn1c1ccccc1

STL003843
Synonyms: 3-methyl-7-(2-phenoxyethyl)-8-(propylamino)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCNc1nc2c(n1CCOc1ccccc1)c(=O)[nH]c(=O)n2C

STL003844
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-bromophenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Brc1cccc(c1)/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N

STL003845
Synonyms: 3-methyl-1-[(4-phenoxybenzyl)oxy]quinoxalin-2(1H)-one4-oxide
Smiles: Cc1[n+]([O-])c2ccccc2n(c1=O)OCc1ccc(cc1)Oc1ccccc1

STL003847
Synonyms: 5-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-[(4-fluorophenyl)carbonyl]-3-hydroxy-1-(5-methyl-1,2-oxazol-3-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(cc(c1O)Br)C1C(=C(C(=O)N1c1noc(c1)C)O)C(=O)c1ccc(cc1)F

STL003848
Synonyms: 9-(4-ethoxyphenyl)-3-hexyl-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCCn1c(=O)c2n3CC(C)CN(c3nc2n(c1=O)C)c1ccc(cc1)OCC

STL003850
Synonyms: 2-({2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5,6-dimethyl-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: OCCN1CCN(CC1)C(=O)CSc1nc2sc(c(c2c(=O)n1CC=C)C)C

STL003851
Synonyms: 8-[4-(2-hydroxyethyl)piperazin-1-yl]-7-[2-hydroxy-3-(2,4,6-tribromophenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCN1CCN(CC1)c1nc2c(n1CC(COc1c(Br)cc(cc1Br)Br)O)c(=O)[nH]c(=O)n2C

STL003852
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{2-[(4-fluorobenzyl)oxy]-3-methoxyphenyl}methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1OCc1ccc(cc1)F)/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N

STL003853
Synonyms: N'-[(E)-(4-methoxyphenyl)methylidene]-2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)CSc1nc2ccccc2c(=O)n1c1ccccc1C

STL003854
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2c2ccc(cc2)C)c2nonc2N)ccc(c1OC)OC

STL003855
Synonyms: 4-propanoylphenyl4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzoate
Smiles: CCC(=O)c1ccc(cc1)OC(=O)c1ccc(cc1)c1nnc(o1)c1ccccc1

STL003856
Synonyms: trans-4-{[({1-[N-(tert-butoxycarbonyl)-L-phenylalanyl]piperidin-4-yl}carbonyl)amino]methyl}cyclohexanecarboxylicacid
Smiles: O=C(C1CCN(CC1)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)NC[C@@H]1CC[C@H](CC1)C(=O)O

STL003857
Synonyms: 5-(4-fluorophenyl)-4-{[(E)-(3-methoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1)/C=N/n1c(S)nnc1c1ccc(cc1)F

STL003859
Synonyms: 3-methyl-8-(4-phenylpiperazin-1-yl)-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2CCSc1ncccn1)N1CCN(CC1)c1ccccc1

STL003860
Synonyms: 2-[(E)-{[3-(3-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]-6-(prop-2-en-1-yl)phenol
Smiles: C=CCc1cccc(c1O)/C=N/n1c(S)nnc1c1cccc(c1)C

STL003861
Synonyms: methyl2-{[{(2E)-2-[4-(diethylamino)benzylidene]hydrazinyl}(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2)CC

STL003862
Synonyms: (5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-[4-(diethylamino)-2-hydroxybenzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCN(c1ccc(c(c1)O)/C=C/1\C(=O)NC(=O)N(C1=O)CCC1=CCCCC1)CC

STL003863
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-difluorophenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1F)F

STL003864
Synonyms: 5-[2-(7-benzyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)hydrazinylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(=NNc2nc3c(n2Cc2ccccc2)c(=O)n(c(=O)n3C)C)C(=O)N1

STL003865
Synonyms: (4Z)-2-(4-bromophenyl)-4-[(2E)-3-(4-nitrophenyl)prop-2-en-1-ylidene]-1,3-oxazol-5(4H)-one
Smiles: Brc1ccc(cc1)C1=N/C(=C\C=C\c2ccc(cc2)[N+](=O)[O-])/C(=O)O1

STL003866
Synonyms: N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-3,4,5-trimethoxy-N-(2-methylphenyl)benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)N(c1ccccc1C)Cc1cc2cccc(c2nc1O)C

STL003868
Synonyms: N-{4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenyl}acetamide
Smiles: CC(c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)NC(=O)C)C

STL003869
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-N'-[(E)-pyridin-4-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1ccncc1

STL003870
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(naphthalen-2-yl)ethylidene]-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1cccs1)c1nonc1N)N/N=C(/c1ccc2c(c1)cccc2)\C

STL003871
Synonyms: 4-{[(E)-(4-chlorophenyl)methylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(cc1)/C=N/n1c(S)nnc1c1cccc(c1)C

STL003872
Synonyms: 2,4-diiodo-6-[(E)-{[3-(3-methoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]phenol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/c1cc(I)cc(c1O)I)S

STL003874
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(2,3-dichlorophenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1cccc(c1Cl)Cl)c1ccccc1Cl

STL003875
Synonyms: 4-methyl-3-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-N-propylbenzenesulfonamide
Smiles: CCCNS(=O)(=O)c1ccc(c(c1)c1nnc2n1nc(C)c1c2cccc1)C

STL003876
Synonyms: 2,3-bis(4-fluorophenyl)-6-methylquinoxaline
Smiles: Fc1ccc(cc1)c1nc2cc(C)ccc2nc1c1ccc(cc1)F

STL003877
Synonyms: [3-amino-4,6-dimethyl-5-(prop-2-en-1-yl)thieno[2,3-b]pyridin-2-yl](phenyl)methanone
Smiles: C=CCc1c(C)nc2c(c1C)c(N)c(s2)C(=O)c1ccccc1

STL003878
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-cyclohexylphenyl)ethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1C(C)C)c1nonc1N)/c1ccc(cc1)C1CCCCC1

STL003879
Synonyms: 4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(3-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/c1ccc(c(c1)Br)OC)S

STL003880
Synonyms: 4-tert-butyl-N-[1-butyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]benzamide
Smiles: CCCCN1C2=C(C(C1=O)(NC(=O)c1ccc(cc1)C(C)(C)C)C(F)(F)F)C(=O)CC(C2)(C)C

STL003881
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,6-dichlorophenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1c(Cl)cccc1Cl

STL003882
Synonyms: 1,3-bis(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea
Smiles: O=C(NC1(C)CCS(=O)(=O)C1)NC1(C)CCS(=O)(=O)C1

STL003883
Synonyms: N-(2-chlorophenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)Nc2ccccc2Cl)c2c(n1)c1ccccc1o2

STL003884
Synonyms: 3-(3,5-dimethyl-1H-pyrazol-4-yl)-N'-[(1Z)-1-(4-hydroxyphenyl)ethylidene]propanehydrazide
Smiles: O=C(CCc1c(C)n[nH]c1C)N/N=C(\c1ccc(cc1)O)/C

STL003885
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1ccc(cc1)C(F)(F)F

STL003886
Synonyms: N-{3-[(1E)-1-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]phenyl}acetamide
Smiles: CC(=O)Nc1cccc(c1)/C(=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)/C

STL003887
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-fluorophenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)F

STL003888
Synonyms: 8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCN1CCN(CC1)c1nc2c(n1CC(=O)c1ccccc1)c(=O)[nH]c(=O)n2C

STL003889
Synonyms: N-(2,4-dimethoxybenzyl)-1-methyl-1H-benzimidazol-2-amine
Smiles: COc1ccc(c(c1)OC)CNc1nc2c(n1C)cccc2

STL003890
Synonyms: 8-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-3-methyl-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)/C=N/Nc1nc2c(n1C(C)C)c(=O)[nH]c(=O)n2C

STL003891
Synonyms: 3-(2-chloro-6-fluorobenzyl)-9-(4-ethylphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1c(F)cccc1Cl

STL003893
Synonyms: 8-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-7-(2-hydroxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C/c2ccccc2Cl)nc2c1c(=O)[nH]c(=O)n2C

STL003894
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-propyl-N'-[(1Z)-1-(pyridin-4-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C(\c1ccncc1)/C

STL003895
Synonyms: 3-(2,5-dimethylbenzyl)-9-(4-ethoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cc(C)ccc1C

STL003896
Synonyms: 6-[2-hydroxy-5-(propan-2-yl)phenyl]-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: CC(c1ccc(c(c1)n1cc2c(c1c1ccccc1)c(=O)n(c(=O)n2C)C)O)C

STL003898
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)SC)nc2c(c1=O)cccc2

STL003899
Synonyms: N'-[(E)-{4-[5-(naphthalen-1-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]phenyl}methylidene]pyridine-3-carbohydrazide
Smiles: O=C(c1cccnc1)N/N=C/c1ccc(cc1)N1N=C(CC1c1cccc2c1cccc2)c1ccccc1

STL003900
Synonyms: 1-benzyl-8-{(2Z)-2-[1-(4-hydroxy-3-methoxyphenyl)ethylidene]hydrazinyl}-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cc(ccc1O)/C(=N\Nc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1)/C

STL003901
Synonyms: 6-(4-benzylpiperazin-1-yl)-1,4-dimethyl-2-oxo-5-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,2-dihydropyridine-3-carbonitrile
Smiles: C=CCN1C(=S)S/C(=C\c2c(C)c(C#N)c(=O)n(c2N2CCN(CC2)Cc2ccccc2)C)/C1=O

STL003902
Synonyms: 3-acetyl-5-(3-chloro-2-methylphenyl)-1-(2-chlorophenyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Smiles: CC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1C)Cl)c1ccccc1Cl

STL003903
Synonyms: 4-{3-hydroxy-4-[(4-methylphenyl)carbonyl]-5-(4-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)S(=O)(=O)N

STL003904
Synonyms: 4-[(E)-{[3-(2-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]-2-methoxyphenol
Smiles: COc1cc(/C=N/n2c(S)nnc2c2ccccc2Cl)ccc1O

STL003905
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CSc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1ccc(cc1)C)c1nonc1N

STL003906
Synonyms: 4-[(4-chlorophenyl)carbonyl]-5-[4-(dimethylamino)phenyl]-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)N(C)C)CCCN1CCOCC1

STL003909
Synonyms: 3-amino-6-(4-fluorophenyl)-N-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cc(NC(=O)c2sc3c(c2N)ccc(n3)c2ccc(cc2)F)cc(c1OC)OC

STL003910
Synonyms: 1-butyl-5-[4-(dimethylamino)phenyl]-3-hydroxy-4-[(4-methylphenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCN1C(c2ccc(cc2)N(C)C)C(=C(C1=O)O)C(=O)c1ccc(cc1)C

STL003911
Synonyms: 3-methyl-8-(4-methylpiperazin-1-yl)-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1cccc3c1cccc3)c(=O)[nH]c(=O)n2C

STL003912
Synonyms: (5Z)-5-{[5-(2,4-dichlorophenyl)furan-2-yl]methylidene}-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2ccc(o2)c2ccc(cc2Cl)Cl)/C1=O

STL003913
Synonyms: 3-(4-hydroxyphenyl)-5-(4-methylphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(cc1)O

STL003914
Synonyms: (5E)-1-(2-ethoxyphenyl)-5-[4-(morpholin-4-yl)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCOc1ccccc1N1C(=O)NC(=O)/C(=C\c2ccc(cc2)N2CCOCC2)/C1=O

STL003916
Synonyms: 3-(2,5-dimethylbenzyl)-1,7-dimethyl-9-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(CCc2ccccc2)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)Cc1cc(C)ccc1C

STL003917
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,6-dichlorophenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1c(Cl)cccc1Cl

STL003918
Synonyms: 1-[(4-chlorobenzyl)sulfanyl]-8-methyl-4-phenyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCc1ccc(cc1)Cl)nn2)c1ccccc1

STL003919
Synonyms: N-[(1Z)-3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]-5-bromofuran-2-carboxamide
Smiles: Brc1ccc(o1)C(=O)N/C(=C\c1ccco1)/C(=O)NCCc1nc2c([nH]1)cccc2

STL003920
Synonyms: 3-{5-[(E)-{2-[(4-amino-1,2,5-oxadiazol-3-yl)carbonyl]hydrazinylidene}methyl]furan-2-yl}benzoicacid
Smiles: O=C(c1nonc1N)N/N=C/c1ccc(o1)c1cccc(c1)C(=O)O

STL003922
Synonyms: 7-(3,4-dichlorobenzyl)-1,3-dimethyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1Cl)Cn1c(N/N=C/c2ccncc2)nc2c1c(=O)n(c(=O)n2C)C

STL003923
Synonyms: 3-butyl-9-(4-methoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(cc1)OC

STL003924
Synonyms: N-(4-bromophenyl)-2-{2-[(4-methoxyphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamide
Smiles: COc1ccc(cc1)NC1=NC(=O)C(S1)CC(=O)Nc1ccc(cc1)Br

STL003925
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(4-propoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: CCCOc1ccc(cc1)/C=N/n1c(S)nnc1c1ccccc1Cl

STL003926
Synonyms: 3-{2-(4-bromophenyl)-4-hydroxy-3-[(4-methylphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzoicacid
Smiles: Brc1ccc(cc1)C1C(=C(C(=O)N1c1cccc(c1)C(=O)O)O)C(=O)c1ccc(cc1)C

STL003927
Synonyms: 2-amino-N-(4-chlorobenzyl)-1-[2-(4-sulfamoylphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Clc1ccc(cc1)CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(cc1)S(=O)(=O)N

STL003928
Synonyms: 6-[5-(4-chlorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,3-dimethoxybenzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)Cl)c1ccccc1

STL003929
Synonyms: 2-{4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-ethoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenoxy}acetamide
Smiles: CCOc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)OCC(=O)N

STL003930
Synonyms: 4-bromo-2-[(E)-{[3-(3-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]phenol
Smiles: Cc1cccc(c1)c1nnc(n1/N=C/c1cc(Br)ccc1O)S

STL003931
Synonyms: N-(2,3-dimethylphenyl)-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)N(c1cccc(c1C)C)Cc1cc2cc(C)ccc2nc1O

STL003932
Synonyms: 2-ethoxy-6-{(E)-[(4-phenylpiperazin-1-yl)imino]methyl}phenol
Smiles: CCOc1cccc(c1O)/C=N/N1CCN(CC1)c1ccccc1

STL003933
Synonyms: N'-[(1E)-1-(furan-2-yl)ethylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C(/c2ccco2)\C)nc2c(c1=O)cccc2

STL003934
Synonyms: N-(3-methoxybenzyl)-1-[2-(morpholin-4-yl)ethyl]-1H-benzimidazol-2-amine
Smiles: COc1cccc(c1)CNc1nc2c(n1CCN1CCOCC1)cccc2

STL003935
Synonyms: 2-chloro-6-(2-chlorophenyl)-7-(2-fluorophenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Clc1ccc2c(c1)C1=C(C(O2)c2ccccc2Cl)C(n2c(N1)ncn2)c1ccccc1F

STL003936
Synonyms: 3-{[4,4-bis(ethoxycarbonyl)octanoyl]amino}benzoicacid
Smiles: CCCCC(C(=O)OCC)(C(=O)OCC)CCC(=O)Nc1cccc(c1)C(=O)O

STL003937
Synonyms: N'-{(E)-[1-(2-methoxyphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}pentanehydrazide
Smiles: CCCCC(=O)NN/C=C/1\C(=O)NC(=S)N(C1=O)c1ccccc1OC

STL003938
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(1E,2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]acetohydrazide
Smiles: COc1ccccc1/C=C/C=N/NC(=O)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl

STL003939
Synonyms: methyl{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccc(cc1)C(C)(C)C

STL003940
Synonyms: N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methylphenyl)sulfanyl]acetamide
Smiles: COc1cc(ccc1OC)c1nnc(s1)NC(=O)CSc1ccc(cc1)C

STL003941
Synonyms: 4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1)c1nnc(n1/N=C/c1cc(ccc1Cl)[N+](=O)[O-])S

STL003942
Synonyms: 7-(2-hydroxyethyl)-8-{(2E)-2-[1-(4-hydroxyphenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C(/c2ccc(cc2)O)\C)nc2c1c(=O)[nH]c(=O)n2C

STL003943
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dichlorophenyl)-N'-[(1E)-1-(naphthalen-2-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)N/N=C(/c1ccc2c(c1)cccc2)\C

STL003944
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-(2,5-dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1/C=N/NC(=O)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)OC

STL003945
Synonyms: 5-(4-ethoxyphenyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)C1N(CCCn2cncc2)C(=O)C(=C1C(=O)c1ccccc1)O

STL003946
Synonyms: methyl(1-methyl-2,4-dioxo-9-phenyl-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl)acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccccc1

STL003947
Synonyms: 2-(3-hexadecyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)-1-(4-nitrophenyl)ethanone
Smiles: CCCCCCCCCCCCCCCCn1c2ccccc2n(c1=N)CC(=O)c1ccc(cc1)[N+](=O)[O-]

STL003948
Synonyms: methyl1-acetyl-5-(3-chlorophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1)Cl)C(=O)C

STL003949
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{2-[(4-fluorobenzyl)oxy]phenyl}methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Fc1ccc(cc1)COc1ccccc1/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N

STL003951
Synonyms: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-benzylidenehydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: Nc1nonc1n1nnc(c1CNc1ccccc1C(=O)N)C(=O)N/N=C/c1ccccc1

STL003952
Synonyms: 2-(5-{(Z)-[1-(4-chlorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-methoxybenzyl)-1H-isoindole-1,3(2H)-dione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)Cl

STL003954
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2C(C)C)c2nonc2N)ccc1OC

STL003956
Synonyms: 5-(4-tert-butylphenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: O=c1c2c(c3ccc(cc3)C(C)(C)C)n(cc2n(c(=O)n1C)C)c1ccc2c(c1)OCCO2

STL003957
Synonyms: ethyl5-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1C)Cl)c1ccc(cc1)OC

STL003958
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(5-chloro-2-hydroxyphenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(Cl)ccc1O

STL003959
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(1,3-benzodioxol-5-yl)ethylidene]-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc2c(c1)OCO2)\C

STL003960
Synonyms: 1,4-dimethyl-5-{(Z)-[3-(4-methylbenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-6-(4-methylpiperidin-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)Cc2ccc(cc2)C)c(n(c1=O)C)N1CCC(CC1)C

STL003961
Synonyms: 3-(2-methoxyethyl)-1,7-dimethyl-9-(3-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cccc(c1)C

STL003962
Synonyms: ethyl7-(4-methylphenyl)-1-nitroso-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(cc1)C)N=O

STL003963
Synonyms: (5E)-1-cyclohexyl-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/NCCCn1ccnc1)C1CCCCC1

STL003964
Synonyms: 6-(3-bromophenyl)-2-chloro-7-(thiophen-2-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Clc1ccc2c(c1)C1=C(C(O2)c2cccc(c2)Br)C(n2c(N1)ncn2)c1cccs1

STL003965
Synonyms: beta-hydroxy-N-[({[(3E,8xi,9xi,14xi)-17-hydroxyandrost-4-en-3-ylidene]amino}oxy)acetyl]phenylalanine
Smiles: O=C(NC(C(c1ccccc1)O)C(=O)O)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2O)C)C

STL003966
Synonyms: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(2-hydroxybenzylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: Nc1nonc1n1nnc(c1CNc1ccccc1C(=O)N)C(=O)N/N=C/c1ccccc1O

STL003967
Synonyms: 3-(3,4-dichlorobenzyl)-9-(3-methoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cccc(c1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(c(c1)Cl)Cl

STL003968
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-methylthiophen-2-yl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1sccc1C

STL003969
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(naphthalen-2-yl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/c1ccc2c(c1)cccc2

STL003970
Synonyms: methyl7-(3-chloro-4-methylphenyl)-1-nitroso-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Smiles: O=NN1N=C(CC21CC(=O)N(C2=O)c1ccc(c(c1)Cl)C)C(=O)OC

STL003971
Synonyms: ethyl2-chloro-5-(5-{(Z)-[1-(4-chlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)benzoate
Smiles: CCOC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=C\1/C(=O)NN(C1=O)c1ccc(cc1)Cl

STL003972
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3Z)-5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/1\C(=O)Nc2c1cc(Br)cc2)C

STL003973
Synonyms: N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-3,4-dimethoxy-N-(3-methylphenyl)benzamide
Smiles: COc1cc(ccc1OC)C(=O)N(c1cccc(c1)C)Cc1cc2cccc(c2nc1O)C

STL003974
Synonyms: 7-(4-chlorobenzyl)-1,3-dimethyl-8-[(4-methylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)n(c(=O)n2C)C

STL003975
Synonyms: 5-[4-(dimethylamino)phenyl]-4-({(E)-[2-(trifluoromethyl)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Smiles: CN(c1ccc(cc1)c1nnc(n1/N=C/c1ccccc1C(F)(F)F)S)C

STL003976
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-pyridin-3-ylmethylidene]acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2cccnc2)nc2c(c1=O)cccc2

STL003977
Synonyms: 4-[3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-2-oxo-4-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]benzenesulfonamide
Smiles: COc1cc(ccc1O)C1C(=C(C(=O)N1c1ccc(cc1)S(=O)(=O)N)O)C(=O)c1ccccc1

STL003978
Synonyms: 2-{[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetohydrazide
Smiles: NNC(=O)COc1cc2oc(C)c(c(=O)c2cc1CC)c1ccc2c(c1)OCCO2

STL003980
Synonyms: 4-[(3-methylphenyl)amino]-3-nitro-2H-chromen-2-one
Smiles: Cc1cccc(c1)Nc1c2ccccc2oc(=O)c1[N+](=O)[O-]

STL003981
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-cyclohexylmethylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/C1CCCCC1

STL003983
Synonyms: 4-{[(E)-(2,5-dimethoxyphenyl)methylidene]amino}-5-[4-(dimethylamino)phenyl]-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(c(c1)/C=N/n1c(S)nnc1c1ccc(cc1)N(C)C)OC

STL003984
Synonyms: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1ncnc2c1oc1c2cccc1

STL003985
Synonyms: N-[({[(3E,8xi,9xi,14xi)-17-hydroxyandrost-4-en-3-ylidene]amino}oxy)acetyl]leucine
Smiles: CC(CC(C(=O)O)NC(=O)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2O)C)C)C

STL003986
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-1H-indol-3-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1c[nH]c2c1cccc2

STL003987
Synonyms: N-(2,3-dimethylphenyl)-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]butanamide
Smiles: CCCC(=O)N(c1cccc(c1C)C)Cc1cc2cc(C)ccc2nc1O

STL003988
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nc(C)nc2c1oc1c2cccc1

STL003989
Synonyms: 8-(3-methylpiperidin-1-yl)-5,7-dinitroquinoline
Smiles: CC1CCCN(C1)c1c(cc(c2c1nccc2)[N+](=O)[O-])[N+](=O)[O-]

STL003990
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(E)-(3-hydroxy-4-methoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1O)/C=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N

STL003992
Synonyms: ethyl4-{(Z)-[2-(naphthalen-1-yl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenylcarbonate
Smiles: CCOC(=O)Oc1ccc(cc1)/C=C/1\N=C(OC1=O)c1cccc2c1cccc2

STL003994
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-methoxyphenyl)ethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)/C

STL003995
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-hydroxyphenyl)methylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1nncn1C)c1nonc1N)N/N=C/c1ccccc1O

STL003996
Synonyms: 5-(3-methoxyphenyl)-4-{[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/C(=C/c1ccccc1)/C)S

STL003997
Synonyms: 2-chloro-N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-N-(3-methoxyphenyl)benzamide
Smiles: COc1cccc(c1)N(C(=O)c1ccccc1Cl)Cc1cc2cccc(c2nc1O)C

STL003998
Synonyms: methyl4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1N

STL003999
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-chloro-6-fluorophenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1c(F)cccc1Cl

STL004000
Synonyms: 2-ethoxy-6-(4-methoxyphenyl)-3-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]pyridine
Smiles: CCOc1nc(ccc1c1noc(n1)c1cc(OC)c(c(c1)OC)OC)c1ccc(cc1)OC

STL004001
Synonyms: N-(2,5-dimethylphenyl)-N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]benzamide
Smiles: Cc1ccc(c(c1)N(C(=O)c1ccccc1)Cc1cc2ccc(cc2nc1O)C)C

STL004002
Synonyms: 2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoicacid
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1ccccc1C(=O)O

STL004003
Synonyms: 9-(4-ethylphenyl)-1,7-dimethyl-3-(3-methylbutyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCc1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STL004004
Synonyms: 8-(2-aminophenyl)-7-(4-chlorophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(cc1)c1cn2c(n1c1ccccc1N)nc1c2c(=O)n(C)c(=O)n1C

STL004005
Synonyms: 1-[(E)-{[3-(3-ethoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]naphthalen-2-ol
Smiles: CCOc1cccc(c1)c1nnc(n1/N=C/c1c(O)ccc2c1cccc2)S

STL004006
Synonyms: 10a-{(E)-2-[3-(4-chloro-3-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]ethenyl}-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: COc1cc(ccc1Cl)c1nn(cc1/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1)c1ccccc1

STL004007
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-ethoxyphenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccccc1/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N

STL004008
Synonyms: 7-(2-chlorobenzyl)-1,3-dimethyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1Cn1c(N/N=C/c2ccncc2)nc2c1c(=O)n(c(=O)n2C)C

STL004009
Synonyms: N'-{(E)-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}-1H-indole-7-carbohydrazide
Smiles: C=CCc1cccc(c1O)/C=N/NC(=O)c1cccc2c1[nH]cc2

STL004010
Synonyms: 1-[3'-(2-chlorophenyl)-4-ethyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone
Smiles: CCC1=NN(c2ccccc2)C2(c3c1cccc3)SC(=NN2c1ccccc1Cl)C(=O)C

STL004011
Synonyms: 6-amino-4-[3-ethoxy-4-(propan-2-yloxy)phenyl]-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1cc(ccc1OC(C)C)C1C(=C(N)Oc2c1c(C)n[nH]2)C#N

STL004012
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-methoxyphenyl)methylidene]-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1ccc(cc1)C)c1nonc1N

STL004013
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,5-difluorophenyl)methylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Fc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N)F

STL004014
Synonyms: 9-(4-ethoxyphenyl)-3-(2-fluorobenzyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1F

STL004016
Synonyms: 1-(4-methylphenyl)-1H-tetrazol-5-yl(1Z)-N-(2-chlorophenyl)-2-oxopropanehydrazonothioate
Smiles: Cc1ccc(cc1)n1nnnc1S/C(=N\Nc1ccccc1Cl)/C(=O)C

STL004017
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-(2,4-dichlorophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1ccc(cc1Cl)Cl

STL004019
Synonyms: 7,8-bis(4-ethoxyphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCOc1ccc(cc1)n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)OCC

STL004020
Synonyms: 4-[(1E)-1-(2-{[(2,5-dimethylphenyl)amino](oxo)acetyl}hydrazinylidene)ethyl]-2-methoxyphenylthiophene-2-carboxylate
Smiles: COc1cc(ccc1OC(=O)c1cccs1)/C(=N/NC(=O)C(=O)Nc1cc(C)ccc1C)/C

STL004021
Synonyms: 1-(4-bromophenyl)-4-[(4-bromophenyl)carbonyl]-5-(4-chlorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C1N(c2ccc(cc2)Br)C(=O)C(=C1C(=O)c1ccc(cc1)Br)O

STL004022
Synonyms: N-(2-methoxyethyl)-2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
Smiles: COCCNS(=O)(=O)c1cc(ccc1C)c1nnc2n1nc(C)c1c2cccc1

STL004023
Synonyms: 3-(2-chloro-6-fluorobenzyl)-9-(3,5-dimethylphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1cc(C)cc(c1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1c(F)cccc1Cl

STL004024
Synonyms: 6-(4-ethylpiperazin-1-yl)-1,4-dimethyl-2-oxo-5-{(Z)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,2-dihydropyridine-3-carbonitrile
Smiles: CCN1CCN(CC1)c1c(/C=C/2\SC(=S)N(C2=O)CC2CCCO2)c(C)c(c(=O)n1C)C#N

STL004025
Synonyms: (5Z)-5-(4-hydroxy-3-methoxybenzylidene)-2-[4-(2-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: COc1cc(ccc1O)/C=C/1\SC(=NC1=O)N1CCN(CC1)c1ccccc1[N+](=O)[O-]

STL004026
Synonyms: 8-benzyl-7-(2,4-dichlorophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(c(c1)Cl)c1cn2c(n1Cc1ccccc1)nc1c2c(=O)n(C)c(=O)n1C

STL004029
Synonyms: (5Z)-1-(4-bromophenyl)-5-[(1-ethyl-2,3-dihydro-1H-indol-5-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCN1CCc2c1ccc(c2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br

STL004030
Synonyms: (5Z)-5-[4-(azepan-1-yl)benzylidene]-1-ethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=S)NC(=O)/C(=C/c2ccc(cc2)N2CCCCCC2)/C1=O

STL004031
Synonyms: 10a-{(E)-2-[4-(benzyloxy)phenyl]ethenyl}-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: O=C1CCN2C(N1)(/C=C/c1ccc(cc1)OCc1ccccc1)C(C)(C)c1c2cccc1

STL004032
Synonyms: 1-(1,3-benzodioxol-5-yl)-2-(4-ethoxyphenyl)-2-hydroxy-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium
Smiles: CCOc1ccc(cc1)C1(O)CN2C(=[N+]1c1ccc3c(c1)OCO3)CCCCC2

STL004033
Synonyms: 4-[(4-ethoxyphenyl)carbonyl]-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-hydroxy-5-(3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccc(c1)OC)c1sc2c(n1)ccc(c2)CC

STL004034
Synonyms: 5-[(Z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-6-(morpholin-4-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)C2CCCCC2)c(n(c1=O)C)N1CCOCC1

STL004035
Synonyms: 8-[(2E)-2-(3,4-dihydronaphthalen-1(2H)-ylidene)hydrazinyl]-1-(4-fluorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)N/N=C/1\CCCc2c1cccc2

STL004036
Synonyms: 6-(3-bromophenyl)-7-(4-methoxyphenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1)C1n2nc(nc2NC2=C1C(Oc1c2cccc1)c1cccc(c1)Br)SC

STL004039
Synonyms: 2-{[4-(4-chlorophenyl)-3-cyano-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2c(C)cc(cc2C)C)NC2=C(C1c1ccc(cc1)Cl)C(=O)CCC2

STL004040
Synonyms: 9a-[(E)-2-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}ethenyl]-9,9-dimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: COc1cc(ccc1OCc1ccc(cc1)Cl)/C=C/C12NC(=O)CN1c1c(C2(C)C)cccc1

STL004041
Synonyms: (4Z)-4-[(1-acetyl-1H-indol-3-yl)methylidene]-2-(2-chloro-4,5-difluorophenyl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1cn(c2c1cccc2)C(=O)C)c1cc(F)c(cc1Cl)F

STL004042
Synonyms: 9-(4-ethylphenyl)-1-methyl-3-pentyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCn1c(=O)c2n3CCCN(c3nc2n(c1=O)C)c1ccc(cc1)CC

STL004043
Synonyms: 8-hydrazinyl-3-methyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(NN)nc2c1c(=O)[nH]c(=O)n2C

STL004044
Synonyms: 5-{[6-hydroxy-1-(3-methylphenyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl](4-methoxy-3-{[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl}phenyl)methyl}-3-(3-methylphenyl)-6-oxo-2-thioxo-1,2,3,6-
Smiles: COc1ccc(cc1C[NH+]1CCN(CC1)c1ccccc1OC)C(c1c(=O)[nH]c(=S)n(c1O)c1cccc(c1)C)c1c(=O)[nH]c(=S)n(c1[O-])c1cccc(c1)C

STL004045
Synonyms: 4-{[(E)-(5-bromo-2-methoxyphenyl)methylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1/C=N/n1c(S)nnc1c1cccc(c1)C)Br

STL004047
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-furan-3-ylmethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1cocc1

STL004048
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CSc2ccc(cc2)C)c2nonc2N)ccc1O

STL004049
Synonyms: 4-{[(E)-(3-fluorophenyl)methylidene]amino}-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Fc1cccc(c1)/C=N/n1c(S)nnc1c1cccnc1

STL004050
Synonyms: (3E)-6-methyl-3-[2-(3-nitrophenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Smiles: Cc1ccc2c(c1)[nH]/c(=C/C(=O)c1cccc(c1)[N+](=O)[O-])/c(=O)o2

STL004051
Synonyms: 2,4-diiodo-6-[(E)-{[3-(pyridin-2-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]phenol
Smiles: Ic1cc(/C=N/n2c(S)nnc2c2ccccn2)c(c(c1)I)O

STL004052
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(2E,3E)-4-[4-(dimethylamino)phenyl]but-3-en-2-ylidene}-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1c1cccs1)c1nonc1N)/C=C/c1ccc(cc1)N(C)C

STL004053
Synonyms: 2-{[3-cyano-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,3-dichlorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2Cl)Cl)NC2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CCC2

STL004054
Synonyms: N-(4-ethoxyphenyl)-4-(4-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: CCOc1ccc(cc1)NC(=S)c1c(c2ccc(cc2)OC)c2c3n1nc(n3CCCC2)c1ccccc1

STL004055
Synonyms: 2-(3,4-dimethoxyphenyl)-5-(2-methylpropyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1cc(ccc1OC)C1=NN2C(C1)c1ccccc1OC2CC(C)C

STL004056
Synonyms: 8-[(2E)-2-(4-ethoxybenzylidene)hydrazinyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCOc1ccc(cc1)/C=N/Nc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STL004057
Synonyms: 6-(4-chlorophenyl)-7-(2-fluorophenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nn2c(n1)NC1=C(C2c2ccccc2F)C(Oc2c1cccc2)c1ccc(cc1)Cl

STL004058
Synonyms: 5-(3-methoxyphenyl)-4-{[(E)-(2-methoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/c1ccccc1OC)S

STL004059
Synonyms: 2-chloro-7-(4-fluorophenyl)-6-(4-methylphenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nn2c(n1)NC1=C(C2c2ccc(cc2)F)C(Oc2c1cc(Cl)cc2)c1ccc(cc1)C

STL004060
Synonyms: ethyl2-{[{(2E)-2-[1-(2,4-dihydroxyphenyl)ethylidene]hydrazinyl}(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C(=O)N/N=C(/c2ccc(cc2O)O)\C)sc2c1CCCC2

STL004061
Synonyms: (4Z)-4-[3-(benzyloxy)benzylidene]-2-(2-chloro-4,5-difluorophenyl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1cccc(c1)OCc1ccccc1)c1cc(F)c(cc1Cl)F

STL004062
Synonyms: 5-(3-chlorophenyl)-2-phenyl-3-(2,4,5-trimethoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: COc1cc(OC)c(cc1C1N(OC2C1C(=O)N(C2=O)c1cccc(c1)Cl)c1ccccc1)OC

STL004063
Synonyms: N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(3-methoxyphenyl)-3-methylbenzamide
Smiles: COc1cccc(c1)N(C(=O)c1cccc(c1)C)Cc1cc2cc(C)ccc2nc1O

STL004064
Synonyms: 4-{2-(4-chlorophenyl)-3-[(4-chlorophenyl)carbonyl]-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzoicacid
Smiles: Clc1ccc(cc1)C1N(c2ccc(cc2)C(=O)O)C(=O)C(=C1C(=O)c1ccc(cc1)Cl)O

STL004065
Synonyms: 7-(2-hydroxyethyl)-8-[(2E)-2-(2-hydroxy-3-methoxybenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C/c2cccc(c2O)OC)nc2c1c(=O)[nH]c(=O)n2C

STL004066
Synonyms: 5-(3-chlorophenyl)-2-phenyl-3-(2,3,4-trimethoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: COc1c(ccc(c1OC)OC)C1N(OC2C1C(=O)N(C2=O)c1cccc(c1)Cl)c1ccccc1

STL004067
Synonyms: (4Z)-2-(2-fluorophenyl)-4-(4-methoxy-3-nitrobenzylidene)-1,3-oxazol-5(4H)-one
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\N=C(OC1=O)c1ccccc1F

STL004068
Synonyms: 6-(4-tert-butylphenyl)-3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Clc1ccc(c(c1)Cl)c1nnc2n1nc(s2)c1ccc(cc1)C(C)(C)C

STL004069
Synonyms: N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-ethoxybenzamide
Smiles: CCOc1cccc(c1)C(=O)Nc1nnc(s1)c1ccc(c(c1)OC)OC

STL004070
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(furan-2-yl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C(/c1ccco1)\C

STL004071
Synonyms: 7-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-3-methyl-8-(4-phenylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)[nH]c(=O)c2c1nc(n2CCSc1nc2c(o1)cccc2)N1CCN(CC1)c1ccccc1

STL004072
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dichlorophenyl)-N'-[(1E)-1-(4-hydroxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Oc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)/C

STL004073
Synonyms: 2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(4-methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1nc(CC)nc2c1oc1c2cccc1

STL004074
Synonyms: (5Z)-1-(3-methylphenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cccc(c1)N1C(=S)NC(=O)/C(=C/c2ccc(s2)[N+](=O)[O-])/C1=O

STL004075
Synonyms: 2-(3,5-dimethylpiperidin-1-yl)-3-{(1E)-1-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]ethyl}-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: COCCN1C(=S)S/C(=C(/c2c(nc3n(c2=O)cc(cc3)C)N2CC(C)CC(C2)C)\C)/C1=O

STL004076
Synonyms: 1,7-dimethyl-9-(3-methylphenyl)-3-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1cccc(c1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STL004077
Synonyms: 5-(2,4-dimethoxyphenyl)-3-hydroxy-4-(phenylcarbonyl)-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(c(c1)OC)C1C(=C(C(=O)N1c1cccc(c1)C(F)(F)F)O)C(=O)c1ccccc1

STL004078
Synonyms: 5-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-6-(morpholin-4-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: CCC(N1C(=S)S/C(=C\c2c(N3CCOCC3)n(C)c(=O)c(c2C)C#N)/C1=O)C

STL004079
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(2-chloro-6-fluorobenzyl)oxy]phenyl}methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1cccc(c1)OCc1c(F)cccc1Cl

STL004080
Synonyms: ethyl5-acetyl-2-({(Z)-2-cyano-2-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2cccs2)/C#N)sc(c1C)C(=O)C

STL004081
Synonyms: 3-butyl-9-(4-ethylphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCn1c(=O)c2n3CC(C)CN(c3nc2n(c1=O)C)c1ccc(cc1)CC

STL004083
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)N/N=C/c1ccc(cc1)N(C)C

STL004084
Synonyms: 7-(4-chlorophenyl)-8-(2,5-dimethoxyphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(c(c1)n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)Cl)OC

STL004085
Synonyms: N-[2,5-dioxo-1-phenyl-4-(trifluoromethyl)imidazolidin-4-yl]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC1(NC(=O)N(C1=O)c1ccccc1)C(F)(F)F

STL004086
Synonyms: benzyl(3R)-6'-amino-1-(2-amino-2-oxoethyl)-5'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Smiles: N#CC1=C(N)OC(=C([C@@]21C(=O)N(c1c2cccc1)CC(=O)N)C(=O)OCc1ccccc1)C

STL004087
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(3-phenoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccccc1c1nnc(n1/N=C/c1cccc(c1)Oc1ccccc1)S

STL004088
Synonyms: 2-(4-bromophenyl)-3,3,5-trimethyl-6-oxo-3,6-dihydro-2H-pyran-4-yl4-chlorobenzenesulfonate
Smiles: Clc1ccc(cc1)S(=O)(=O)OC1=C(C)C(=O)OC(C1(C)C)c1ccc(cc1)Br

STL004089
Synonyms: N-(2,4-dimethylphenyl)-N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-3-nitrobenzamide
Smiles: Cc1ccc(c(c1)C)N(C(=O)c1cccc(c1)[N+](=O)[O-])Cc1cc2ccc(cc2nc1O)C

STL004090
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-fluorophenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)F

STL004091
Synonyms: 1,7-dimethyl-3-(3-methylbenzyl)-9-(3-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1cccc(c1)Cn1c(=O)c2n3CC(C)CN(c3nc2n(c1=O)C)c1cccc(c1)C

STL004092
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-fluorophenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1ccccc1F

STL004093
Synonyms: 3-(1H-benzotriazol-1-yl)-N'-[(1Z)-1-(4-chlorophenyl)ethylidene]propanehydrazide
Smiles: O=C(CCn1nnc2c1cccc2)N/N=C(\c1ccc(cc1)Cl)/C

STL004094
Synonyms: 2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(4-fluorophenyl)ethanone
Smiles: CCc1nc(SCC(=O)c2ccc(cc2)F)c2c(n1)c1ccccc1o2

STL004095
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(OC)c(cc1OC)OC

STL004096
Synonyms: N-(3-chlorophenyl)-1-(4-fluorophenyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)Cl)c1ccc(cc1)F

STL004097
Synonyms: N-(2,4-dimethylphenyl)-N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-4-nitrobenzamide
Smiles: Cc1ccc(c(c1)C)N(C(=O)c1ccc(cc1)[N+](=O)[O-])Cc1cc2ccc(cc2nc1O)C

STL004098
Synonyms: (5E)-5-[(cyclopentylamino)methylidene]-1-(2,4-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)NC(=O)/C(=C\NC2CCCC2)/C1=O

STL004099
Synonyms: N-{3-[(1E)-1-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dichlorophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]phenyl}acetamide
Smiles: CC(=O)Nc1cccc(c1)/C(=N/NC(=O)c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)/C

STL004100
Synonyms: (8xi,9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl4-[(1,3-benzodioxol-5-ylmethyl)amino]-4-oxobutanoate
Smiles: O=C(OCC(=O)[C@@]1(O)CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C)CCC(=O)NCc1ccc2c(c1)OCO2

STL004101
Synonyms: 6-bromo-4-phenyl-3-[5-phenyl-1-(phenylsulfonyl)-4,5-dihydro-1H-pyrazol-3-yl]quinolin-2(1H)-one
Smiles: Brc1ccc2c(c1)c(c1ccccc1)c(c(=O)[nH]2)C1=NN(C(C1)c1ccccc1)S(=O)(=O)c1ccccc1

STL004102
Synonyms: 2-[(2,4-dichlorobenzyl)sulfanyl]-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)c1CCCc1s2

STL004103
Synonyms: N,N'-{[4-(propan-2-yloxy)benzene-1,3-diyl]dimethanediyl}bis(N-ethyl-N-methylethanaminium)
Smiles: CC[N+](Cc1ccc(c(c1)C[N+](CC)(CC)C)OC(C)C)(CC)C

STL004104
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(3-hydroxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)O

STL004106
Synonyms: 6-cyclohexyl-9-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one
Smiles: O=C1CCCc2c1n(C)c1c2cc(cc1)C1CCCCC1

STL004107
Synonyms: 8-(2-amino-4,5-dimethylphenyl)-7-(4-chlorophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(cc1)c1cn2c(n1c1cc(C)c(cc1N)C)nc1c2c(=O)n(C)c(=O)n1C

STL004108
Synonyms: methyl7-(4-methylphenyl)-1-nitroso-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Smiles: O=NN1N=C(CC21CC(=O)N(C2=O)c1ccc(cc1)C)C(=O)OC

STL004109
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxyphenyl)methylidene]-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)O

STL004110
Synonyms: (5Z)-5-({[2-(dimethylamino)ethyl]amino}methylidene)-1-(2,3-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CN(CCN/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1C)C)C

STL004111
Synonyms: (5Z)-5-(4-methoxybenzylidene)-4-thioxo-1,3-thiazolidin-2-one
Smiles: COc1ccc(cc1)/C=C/1\SC(=O)NC1=S

STL004112
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-N'-[(1E)-1-(pyridin-4-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C(/c1ccncc1)\C

STL004113
Synonyms: beta-hydroxy-N-[({[(3E,8xi,9xi,14xi,17xi)-20-oxopregn-4-en-3-ylidene]amino}oxy)acetyl]phenylalanine
Smiles: O=C(NC(C(c1ccccc1)O)C(=O)O)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2C(=O)C)C)C

STL004114
Synonyms: 6-(2,6-dimethylmorpholin-4-yl)-5-{(Z)-[3-(4-fluorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)Cc2ccc(cc2)F)c(n(c1=O)C)N1CC(C)OC(C1)C

STL004115
Synonyms: 2-methoxy-4-[(E)-{[3-(3-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]phenol
Smiles: COc1cc(/C=N/n2c(S)nnc2c2cccc(c2)C)ccc1O

STL004116
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-[(E)-(3-methylthiophen-2-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1sccc1C

STL004117
Synonyms: 4-({(E)-[4-(benzyloxy)phenyl]methylidene}amino)-5-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1)c1nnc(n1/N=C/c1ccc(cc1)OCc1ccccc1)S

STL004118
Synonyms: 1-{4-[2-(benzyloxy)ethoxy]but-2-yn-1-yl}-4-(diphenylmethyl)piperazine
Smiles: O(CCOCc1ccccc1)CC#CCN1CCN(CC1)C(c1ccccc1)c1ccccc1

STL004119
Synonyms: tert-butyl[(2S)-4-methyl-1-oxo-1-(4-{[(2S)-1-oxo-1-{[4-(propan-2-yl)phenyl]amino}propan-2-yl]carbamoyl}piperidin-1-yl)pentan-2-yl]carbamate
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)C(C)C)C)NC(=O)OC(C)(C)C)C

STL004120
Synonyms: N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-N-(3-methoxyphenyl)-4-methylbenzamide
Smiles: COc1cccc(c1)N(C(=O)c1ccc(cc1)C)Cc1cc2ccc(cc2nc1O)C

STL004121
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-furan-2-ylmethylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1ccco1)c1ccccc1Cl

STL004122
Synonyms: 9-{2-[1-(4-chlorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-2-oxoethoxy}-7-methyl-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Smiles: Cc1cc(OCC(=O)N2CCC3(C(C2c2ccc(cc2)Cl)CCCC3)O)c2c(c1)oc(=O)c1c2CCC1

STL004124
Synonyms: (8xi,9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl4-[(2,2-dimethoxyethyl)amino]-4-oxobutanoate
Smiles: COC(CNC(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C)OC

STL004125
Synonyms: (5Z)-5-[4-(azepan-1-yl)benzylidene]-1-(butan-2-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCC(N1C(=S)NC(=O)/C(=C/c2ccc(cc2)N2CCCCCC2)/C1=O)C

STL004126
Synonyms: 4-[(4-ethoxyphenyl)carbonyl]-3-hydroxy-1-(pyridin-3-ylmethyl)-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cc(OC)c(c(c1)OC)OC)Cc1cccnc1

STL004128
Synonyms: N-(3,5-dimethylphenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)Nc2cc(C)cc(c2)C)c2c(n1)c1ccccc1o2

STL004129
Synonyms: 4-({(E)-[3-(benzyloxy)phenyl]methylidene}amino)-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1cccc(c1)OCc1ccccc1)c1ccccn1

STL004130
Synonyms: dimethyl1-(3-chlorophenyl)-8-methyl-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate
Smiles: COC(=O)C1=NN(C2(S1)SC(=C(N2c1ccccc1)C)C(=O)OC)c1cccc(c1)Cl

STL004131
Synonyms: 2-(4-{(1E)-1-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]ethyl}phenoxy)acetamide
Smiles: NC(=O)COc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/C

STL004132
Synonyms: 5-(3-chlorophenyl)-4-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Clc1cccc(c1)c1nnc(n1/N=C/C=C/c1ccccc1[N+](=O)[O-])S

STL004133
Synonyms: 2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nc(CC)nc2c1oc1c2cccc1

STL004134
Synonyms: 1-(2-methylphenyl)-3-[5-(4-nitrobenzyl)-1,3,4-thiadiazol-2-yl]urea
Smiles: O=C(Nc1ccccc1C)Nc1nnc(s1)Cc1ccc(cc1)[N+](=O)[O-]

STL004135
Synonyms: N-(2,4-dichlorobenzyl)-1-(2-phenylethyl)-9H-beta-carboline-3-carboxamide
Smiles: Clc1ccc(c(c1)Cl)CNC(=O)c1nc(CCc2ccccc2)c2c(c1)c1ccccc1[nH]2

STL004136
Synonyms: 2-chloro-4-{(Z)-[2-(2-chloro-4,5-difluorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-6-methoxyphenylacetate
Smiles: COc1cc(/C=C/2\N=C(OC2=O)c2cc(F)c(cc2Cl)F)cc(c1OC(=O)C)Cl

STL004137
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)OCc1ccccc1)C

STL004138
Synonyms: 5,7-dinitro-N-phenylquinolin-8-amine
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c2c(c1Nc1ccccc1)nccc2

STL004139
Synonyms: N'-[(E)-(2-methylphenyl)methylidene]-2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1C)N/N=C/c1ccccc1C

STL004140
Synonyms: 7-(4-chlorophenyl)-8-(3,5-dimethylphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(cc1)c1cn2c(n1c1cc(C)cc(c1)C)nc1c2c(=O)n(C)c(=O)n1C

STL004141
Synonyms: N-(2-{[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]amino}-2-oxoethyl)-2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]propanamide
Smiles: CCCc1cc(=O)oc2c1c(cc(c2)C)OC(C(=O)NCC(=O)NCC(=O)N1CCC2(C(C1)CCCC2)O)C

STL004142
Synonyms: methyl[1-methyl-9-(4-methylphenyl)-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)C

STL004143
Synonyms: 4-[(4-chlorophenyl)carbonyl]-5-(3-ethoxy-4-hydroxyphenyl)-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cc(ccc1O)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(cc1)Cl)O

STL004144
Synonyms: N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-2-methoxy-N-(2-methoxyphenyl)benzamide
Smiles: COc1ccccc1N(C(=O)c1ccccc1OC)Cc1cc2cc(C)ccc2nc1O

STL004145
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(3-methylthiophen-2-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Clc1cccc(c1)c1nnc(n1/N=C/c1sccc1C)S

STL004146
Synonyms: (5E)-1-(3-chlorophenyl)-5-({[3-(dimethylamino)propyl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN(CCCN/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1)Cl)C

STL004147
Synonyms: 1,4-dimethyl-2-oxo-5-{(Z)-[4-oxo-3-(3-phenylpropyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-6-(piperidin-1-yl)-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCCc2ccccc2)c(n(c1=O)C)N1CCCCC1

STL004148
Synonyms: (8xi,9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl4-oxo-4-[(tetrahydrofuran-2-ylmethyl)amino]butanoate
Smiles: O=C(CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C)NCC1CCCO1

STL004150
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-[(E)-thiophen-3-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cscc1

STL004152
Synonyms: 8-(3-chloro-2-methylphenyl)-7-(3-methoxyphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cccc(c1)c1cn2c(n1c1cccc(c1C)Cl)nc1c2c(=O)n(C)c(=O)n1C

STL004153
Synonyms: 5-(3-ethoxyphenyl)-4-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1cccc(c1)c1nnc(n1/N=C/c1cc(OC)c(c(c1)OC)OC)S

STL004154
Synonyms: (2E)-2-cyano-3-[2-(2,4-dichlorophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide
Smiles: N#C/C(=C\c1c(Oc2ccc(cc2Cl)Cl)nc2n(c1=O)cccc2C)/C(=O)NC1CCS(=O)(=O)C1

STL004155
Synonyms: ethyl7-(3,4-dimethylphenyl)-1-nitroso-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(c(c1)C)C)N=O

STL004156
Synonyms: 7-[(4-methoxyphenoxy)methyl]-1,3-dimethyl-6,7-dihydro[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: COc1ccc(cc1)OCC1Oc2n(C1)c1c(n2)n(C)c(=O)n(c1=O)C

STL004157
Synonyms: 5-(3-methoxyphenyl)-4-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/c1ccc(c(c1OC)OC)OC)S

STL004158
Synonyms: N-{3-[(1E)-1-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-propyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]phenyl}acetamide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1cccc(c1)NC(=O)C)\C

STL004160
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)OC

STL004161
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-{2-[(4-fluorobenzyl)oxy]phenyl}methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1OCc1ccc(cc1)F)C

STL004162
Synonyms: 6-(3-bromophenyl)-7-(4-methylphenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nc2n(n1)C(c1ccc(cc1)C)C1=C(N2)c2ccccc2OC1c1cccc(c1)Br

STL004163
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-2,3-dihydro-1H-inden-1-ylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CSc1ccccc1)C(=O)N/N=C/1\CCc2c1cccc2

STL004164
Synonyms: [5-(4-methoxyphenyl)furan-2-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanethione
Smiles: COc1ccc(cc1)c1ccc(o1)C(=S)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STL004165
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-(3-fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1cccc(c1)F

STL004166
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-chlorophenyl)ethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)/C

STL004168
Synonyms: 3-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N'-phenylpropanehydrazide
Smiles: O=C(NNc1ccccc1)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STL004169
Synonyms: 4-[(4-bromophenyl)carbonyl]-3-hydroxy-5-(4-hydroxyphenyl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Oc1ccc(cc1)C1N(CCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(cc1)Br)O

STL004170
Synonyms: N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl}-2-methoxybenzamide
Smiles: COc1cc(CCN2C(=O)NC(C2=O)(NC(=O)c2ccccc2OC)C(F)(F)F)ccc1OC

STL004171
Synonyms: (2E)-N-(1,3-benzothiazol-2-yl)-3-(thiophen-2-yl)prop-2-enamide
Smiles: O=C(Nc1nc2c(s1)cccc2)/C=C/c1cccs1

STL004172
Synonyms: 8-(butan-2-ylamino)-3-methyl-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCC(Nc1nc2c(n1CCOc1ccccc1)c(=O)[nH]c(=O)n2C)C

STL004173
Synonyms: (3s,5s,7s)-N-[5-(2-methoxyphenyl)-1,3,4-thiadiazol-2-yl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: COc1ccccc1c1nnc(s1)NC(=O)C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3

STL004175
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)OC

STL004176
Synonyms: 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-N'-[(E)-(4-methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)Cn1c(nc2c1cccc2)c1nonc1N

STL004177
Synonyms: 7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-8-[(3-methoxypropyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCCNc1nc2c(n1CC(COc1ccc(cc1)CC)O)c(=O)[nH]c(=O)n2C

STL004178
Synonyms: 4-({(E)-[4-(benzyloxy)phenyl]methylidene}amino)-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1)c1nnc(n1/N=C/c1ccc(cc1)OCc1ccccc1)S

STL004179
Synonyms: (5E)-5-({[3-(diethylamino)propyl]amino}methylidene)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN(CCCN/C=C/1\C(=O)NC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC)CC

STL004180
Synonyms: 1-(3-bromophenyl)-5-(3-fluorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1cccc(c1)C1C(=C(C(=O)N1c1cccc(c1)Br)O)C(=O)c1ccccc1

STL004181
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(4-fluorophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)F

STL004183
Synonyms: 2-{[4-amino-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1N)c1ccccc1Cl

STL004184
Synonyms: N'-[(E)-(2-hydroxy-3,5-diiodophenyl)methylidene]-2-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1cccc2c1cccc2)N/N=C/c1cc(I)cc(c1O)I

STL004185
Synonyms: 3,4-dichloro-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: COc1cc(ccc1OC)c1nnc(s1)NC(=O)c1ccc(c(c1)Cl)Cl

STL004186
Synonyms: 3-(2-chloro-6-fluorobenzyl)-1-methyl-9-(3-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1cccc(c1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1c(F)cccc1Cl

STL004187
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]-5-propyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(Br)ccc1O

STL004188
Synonyms: 2-[(8-benzyl-4-ethyl-5-oxo-4,5,6,7,8,9-hexahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]-N-(4-methylphenyl)acetamide
Smiles: CCn1c2nnc(n2c2c(c1=O)c1CCN(Cc1s2)Cc1ccccc1)SCC(=O)Nc1ccc(cc1)C

STL004189
Synonyms: N'-{(E)-[4-(benzyloxy)phenyl]methylidene}-2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1C)N/N=C/c1ccc(cc1)OCc1ccccc1

STL004190
Synonyms: 3-amino-6-(4-fluorophenyl)-N-(4-methoxybenzyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1sc2c(c1N)ccc(n2)c1ccc(cc1)F

STL004191
Synonyms: 7-benzyl-8-[(4-benzylpiperazin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2Cc1ccccc1)CN1CCN(CC1)Cc1ccccc1

STL004192
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(1E)-1-(4-methylphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)C)\C

STL004193
Synonyms: 5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-1,3-bis(2-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Cc1ccccc1N1C(=O)/C(=C/NC2CCN(CC2)Cc2ccccc2)/C(=O)N(C1=S)c1ccccc1C

STL004194
Synonyms: 6-(8-aminonaphthalen-1-yl)-1,3-dimethyl-5-(3-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Cc1cccc(c1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1cccc2c1c(N)ccc2

STL004195
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)C(F)(F)F

STL004196
Synonyms: (2E)-2-({1-[2-(3-methoxyphenoxy)ethyl]-1H-indol-3-yl}methylidene)-N-methylhydrazinecarbothioamide
Smiles: CNC(=S)N/N=C/c1cn(c2c1cccc2)CCOc1cccc(c1)OC

STL004197
Synonyms: methyl5-(3-bromophenyl)-1-nitroso-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: O=NN1N=C(C2C1C(=O)N(C2=O)c1cccc(c1)Br)C(=O)OC

STL004198
Synonyms: 7-benzyl-8-[(dibenzylamino)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2Cc1ccccc1)CN(Cc1ccccc1)Cc1ccccc1

STL004201
Synonyms: (5Z)-5-({[3-(dimethylamino)propyl]amino}methylidene)-1-phenylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CN(CCCN/C=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1)C

STL004202
Synonyms: 2-{(2Z)-2-[(2E)-(4-hydroxy-3-methoxybenzylidene)hydrazinylidene]-4-oxo-1,3-thiazolidin-5-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: COc1cc(/C=N/N=C/2\SC(C(=O)N2)CC(=O)Nc2cccc(c2)C(F)(F)F)ccc1O

STL004203
Synonyms: 5-(2,4-dimethoxyphenyl)-3-hydroxy-4-[(2E)-3-phenylprop-2-enoyl]-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(c(c1)OC)C1C(=C(C(=O)N1c1cccc(c1)C(F)(F)F)O)C(=O)/C=C/c1ccccc1

STL004204
Synonyms: 1,3-dimethyl-7-(naphthalen-1-ylmethyl)-8-{[2-(piperidin-1-yl)ethyl]sulfanyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2Cc1cccc2c1cccc2)SCCN1CCCCC1

STL004205
Synonyms: 4-({(E)-[3-(benzyloxy)phenyl]methylidene}amino)-5-[4-(dimethylamino)phenyl]-4H-1,2,4-triazole-3-thiol
Smiles: CN(c1ccc(cc1)c1nnc(n1/N=C/c1cccc(c1)OCc1ccccc1)S)C

STL004206
Synonyms: (5Z)-1-(4-methylphenyl)-2-thioxo-5-(2,3,4-trimethoxybenzylidene)dihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccc(c(c1OC)OC)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)C

STL004207
Synonyms: 3-{2-(4-bromophenyl)-3-[(4-bromophenyl)carbonyl]-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzoicacid
Smiles: Brc1ccc(cc1)C1C(=C(C(=O)N1c1cccc(c1)C(=O)O)O)C(=O)c1ccc(cc1)Br

STL004208
Synonyms: (5E)-1-(furan-2-ylmethyl)-5-{[(furan-2-ylmethyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/NCc1ccco1)Cc1ccco1

STL004209
Synonyms: N-[(2-hydroxyquinolin-3-yl)methyl]-3,4-dimethoxy-N-phenylbenzamide
Smiles: COc1cc(ccc1OC)C(=O)N(c1ccccc1)Cc1cc2ccccc2nc1O

STL004210
Synonyms: N-(2,5-dimethoxyphenyl)-2,3-diphenylquinoxaline-6-carboxamide
Smiles: COc1ccc(c(c1)NC(=O)c1ccc2c(c1)nc(c(n2)c1ccccc1)c1ccccc1)OC

STL004211
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)O

STL004212
Synonyms: 1-(4-ethoxyphenyl)-3-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]urea
Smiles: CCOc1ccc(cc1)NC(=O)Nc1nnc(s1)c1cccc(c1)C

STL004213
Synonyms: 2-[(2-phenylethyl)sulfanyl]-1,3-benzothiazole
Smiles: c1ccc(cc1)CCSc1nc2c(s1)cccc2

STL004214
Synonyms: 7-{2-[1-(4-chlorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-2-oxoethoxy}-4-(trifluoromethyl)-2H-chromen-2-one
Smiles: Clc1ccc(cc1)C1N(CCC2(C1CCCC2)O)C(=O)COc1ccc2c(c1)oc(=O)cc2C(F)(F)F

STL004215
Synonyms: 3-benzyl-1,7-dimethyl-9-(3-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1cccc(c1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1

STL004216
Synonyms: 5-(4-tert-butylphenyl)-4-[(4-chlorophenyl)carbonyl]-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)CCCN1CCOCC1

STL004218
Synonyms: 8-bromo-3-methyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

STL004219
Synonyms: tert-butyl[(1S)-1-{5-[(3-chlorobenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}-3-methylbutyl]carbamate
Smiles: CC(C[C@@H](c1nnc(o1)SCc1cccc(c1)Cl)NC(=O)OC(C)(C)C)C

STL004220
Synonyms: 3-amino-6-(3,4-dimethoxyphenyl)-N-(4-fluorophenyl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cc(ccc1OC)c1nc2sc(c(c2c(c1)C(F)(F)F)N)C(=O)Nc1ccc(cc1)F

STL004221
Synonyms: 1-[1-(4-chlorophenyl)-4-(4-fluorophenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]butan-1-one
Smiles: CCCC(=O)c1c(c2ccc(cc2)Cl)c2c3n1cc(n3CCCC2)c1ccc(cc1)F

STL004222
Synonyms: 3-chloro-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: COc1ccc(cc1OC)c1nnc(s1)NC(=O)c1cccc(c1)Cl

STL004223
Synonyms: 4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-5-(3-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1cccc(c1)c1nnc(n1/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl)S

STL004224
Synonyms: 4-({(E)-[3-(benzyloxy)-4-methoxyphenyl]methylidene}amino)-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1OCc1ccccc1)/C=N/n1c(S)nnc1c1cccc(c1)C

STL004226
Synonyms: 5,7-dinitro-2,1,3-benzoxadiazole-4,6-diamine1-oxide
Smiles: [O-][N+](=O)c1c2[n+]([O-])onc2c(c(c1N)[N+](=O)[O-])N

STL004228
Synonyms: 4-({(E)-[4-(benzyloxy)phenyl]methylidene}amino)-5-(2-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccccc1c1nnc(n1/N=C/c1ccc(cc1)OCc1ccccc1)S

STL004229
Synonyms: (5Z)-2-(4-methylpiperazin-1-yl)-5-[2-(prop-2-en-1-yloxy)benzylidene]-1,3-thiazol-4(5H)-one
Smiles: C=CCOc1ccccc1/C=C/1\SC(=NC1=O)N1CCN(CC1)C

STL004230
Synonyms: 2-(diethylamino)ethyl4-({(E)-[1-(4-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)N/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl)CC

STL004231
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-{2-[(4-fluorobenzyl)oxy]-3-methoxyphenyl}methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1OCc1ccc(cc1)F)/C=N/NC(=O)c1nnn(c1CN(C)C)c1nonc1N

STL004232
Synonyms: {4-[(5-chloro-2-methoxyphenyl)sulfonyl]piperazin-1-yl}[3-methyl-1-(2-methylphenyl)-1H-thieno[2,3-c]pyrazol-5-yl]methanone
Smiles: COc1ccc(cc1S(=O)(=O)N1CCN(CC1)C(=O)c1sc2c(c1)c(nn2c1ccccc1C)C)Cl

STL004233
Synonyms: 2-bromo-6-methoxy-4-[(E)-{[3-(3-methoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]phenol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/c1cc(Br)c(c(c1)OC)O)S

STL004234
Synonyms: (4Z)-4-{[5-(2,4-dichlorophenyl)furan-2-yl]methylidene}-2-(2-fluorophenyl)-1,3-oxazol-5(4H)-one
Smiles: Clc1ccc(c(c1)Cl)c1ccc(o1)/C=C/1\N=C(OC1=O)c1ccccc1F

STL004235
Synonyms: ethyl[3-acetyl-2-(4-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]acetate
Smiles: CCOC(=O)CN1C(=O)C(=C(C1c1ccc(cc1)F)C(=O)C)O

STL004236
Synonyms: 9-(3,5-dimethylphenyl)-1,7-dimethyl-3-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(c2cc(C)cc(c2)C)c2n(C1)c1c(=O)n(CCc3ccccc3)c(=O)n(c1n2)C

STL004237
Synonyms: 6-bromo-2-[(E)-2-(2-hydroxyphenyl)ethenyl]-3-phenylquinazolin-4(3H)-one
Smiles: Brc1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccccc1O)c1ccccc1

STL004239
Synonyms: (5Z)-5-({2,5-dimethyl-1-[4-(morpholin-4-yl)phenyl]-1H-pyrrol-3-yl}methylidene)-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=S)NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)N2CCOCC2)C)/C1=O

STL004240
Synonyms: 4-[(4-bromophenyl)carbonyl]-1-(5-tert-butyl-1,2-oxazol-3-yl)-5-(3-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1cccc(c1)C1N(c2noc(c2)C(C)(C)C)C(=O)C(=C1C(=O)c1ccc(cc1)Br)O

STL004241
Synonyms: 3-(3,4-dichlorobenzyl)-1-methyl-9-(4-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(c(c1)Cl)Cl

STL004242
Synonyms: 1-(6-bromo-1,3-benzothiazol-2-yl)-3-hydroxy-5-phenyl-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Brc1ccc2c(c1)sc(n2)N1C(c2ccccc2)C(=C(C1=O)O)C(=O)c1ccccc1

STL004243
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-naphthalen-1-ylmethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1cccc2c1cccc2

STL004244
Synonyms: N-[2-(2-{(Z)-[1-(4-methylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-3-yl)ethyl]acetamide
Smiles: CC(=O)NCCc1c(/C=C\2/C(=O)NC(=S)N(C2=O)c2ccc(cc2)C)[nH]c2c1cccc2

STL004245
Synonyms: 5-(4-fluorophenyl)-4-{[(E)-(3-phenoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Fc1ccc(cc1)c1nnc(n1/N=C/c1cccc(c1)Oc1ccccc1)S

STL004247
Synonyms: 3-amino-N-(2,3-dimethylphenyl)-6-(4-methoxyphenyl)-4-(4-methylphenyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1ccc(cc1)c1nc2sc(c(c2c(c1)c1ccc(cc1)C)N)C(=O)Nc1cccc(c1C)C

STL004249
Synonyms: 1-(4-chlorophenyl)-5-{[3-(4-chlorophenyl)-6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl][4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]methyl}-6-oxo-2-thioxo-1,2,3,6-tetrahydropyrimidin-4
Smiles: COc1ccc(cc1C[NH+]1CCOCC1)C(c1c(O)[nH]c(=S)n(c1=O)c1ccc(cc1)Cl)c1c([O-])[nH]c(=S)n(c1=O)c1ccc(cc1)Cl

STL004250
Synonyms: N-[2-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)ethyl]-N-(naphthalen-1-yl)acetamide(non-preferredname)
Smiles: CC(=O)N(c1cccc2c1cccc2)CCN1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3

STL004251
Synonyms: 9a-[(E)-2-(2,6-dichlorophenyl)ethenyl]-9,9-dimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: O=C1CN2C(N1)(/C=C/c1c(Cl)cccc1Cl)C(c1c2cccc1)(C)C

STL004252
Synonyms: 2-{[2-(3,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-4,6-bis(4-methoxyphenyl)pyridine-3-carbonitrile
Smiles: COc1ccc(cc1)c1nc(SCC(=O)c2ccc(c(c2)Cl)Cl)c(c(c1)c1ccc(cc1)OC)C#N

STL004253
Synonyms: 8-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)/C=N/Nc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STL004254
Synonyms: (4Z)-2-(4-chloro-3-nitrophenyl)-4-(4-methoxy-3-nitrobenzylidene)-1,3-oxazol-5(4H)-one
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\N=C(OC1=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STL004255
Synonyms: 2-[(3-chlorobenzyl)sulfanyl]-3-(propan-2-yloxy)quinazolin-4(3H)-one
Smiles: Clc1cccc(c1)CSc1nc2ccccc2c(=O)n1OC(C)C

STL004256
Synonyms: 1,4-dimethyl-2-oxo-5-{(Z)-[4-oxo-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-6-(piperidin-1-yl)-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)C(c2ccccc2)C)c(n(c1=O)C)N1CCCCC1

STL004257
Synonyms: 3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCSc1nnnn1c1ccccc1)c(n2)N1CCCCC1)C

STL004258
Synonyms: N'-[(E)-anthracen-9-ylmethylidene]-2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1c2ccccc2cc2c1cccc2

STL004259
Synonyms: (6E)-6-(4-fluorobenzylidene)-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Fc1ccc(cc1)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F

STL004260
Synonyms: (5E)-1-(3-chlorophenyl)-5-({[2-(pyridin-3-yl)piperidin-1-yl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Clc1cccc(c1)N1C(=S)NC(=O)/C(=C\NN2CCCCC2c2cccnc2)/C1=O

STL004261
Synonyms: 6-(2-hydroxy-3,5-dimethylphenyl)-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Cc1cc(C)c(c(c1)n1cc2c(c1c1ccccc1)c(=O)n(c(=O)n2C)C)O

STL004262
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(4-fluorobenzyl)oxy]-3-methoxyphenyl}methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2C(C)C)c2nonc2N)ccc1OCc1ccc(cc1)F

STL004263
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(5-methylthiophen-2-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Clc1cccc(c1)c1nnc(n1/N=C/c1ccc(s1)C)S

STL004264
Synonyms: 4-{[(E)-(2-methoxyphenyl)methylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccccc1/C=N/n1c(S)nnc1c1cccc(c1)C

STL004265
Synonyms: ethyl5-(4-bromophenyl)-1-(4-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccc(cc1)C

STL004266
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(OC)c(c(c1)OC)OC

STL004267
Synonyms: 5-(4-ethoxyphenyl)-4-{(2E)-2-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]hydrazinyl}-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1)c1nnc(n1N/N=C/C=C/c1ccco1)S

STL004268
Synonyms: N'-[(E)-(1-butyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]benzohydrazide
Smiles: CCCCN1C(=S)NC(=O)/C(=C\NNC(=O)c2ccccc2)/C1=O

STL004269
Synonyms: 3-(4-chlorobenzyl)-9-(3-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cccc(c1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)Cl

STL004270
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-ethoxyphenyl)-N'-[(E)-(3-hydroxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)O

STL004271
Synonyms: 6,6'-dibromo-N-(4-methoxyphenyl)-4',5-diphenyl-2,3'-biquinolin-2'-amine
Smiles: COc1ccc(cc1)Nc1nc2ccc(cc2c(c1c1ccc2c(n1)ccc(c2c1ccccc1)Br)c1ccccc1)Br

STL004272
Synonyms: N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-3,4-dimethoxy-N-(3-methoxyphenyl)benzamide
Smiles: COc1cccc(c1)N(C(=O)c1ccc(c(c1)OC)OC)Cc1cc2cccc(c2nc1O)C

STL004273
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)C(F)(F)F)nc2c(c1=O)cccc2

STL004274
Synonyms: methyl4-{4-hydroxy-1-[3-(morpholin-4-yl)propyl]-5-oxo-3-(thiophen-2-ylcarbonyl)-2,5-dihydro-1H-pyrrol-2-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1cccs1)O

STL004275
Synonyms: (4Z)-4-[(1-acetyl-1H-indol-3-yl)methylidene]-2-(4-ethylphenyl)-1,3-oxazol-5(4H)-one
Smiles: CCc1ccc(cc1)C1=N/C(=C\c2cn(c3c2cccc3)C(=O)C)/C(=O)O1

STL004276
Synonyms: tert-butyl[5-(5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)pentyl]carbamate
Smiles: O=C(OC(C)(C)C)NCCCCCc1nnc(o1)SCC(=O)c1ccc(cc1)Cl

STL004277
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1OC)/C=N/n1c(S)nnc1c1ccccc1Cl

STL004278
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,6-dichlorophenyl)methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1c(Cl)cccc1Cl)C

STL004279
Synonyms: 3-methyl-7-(4-methylbenzyl)-8-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)Cn1c(N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C

STL004281
Synonyms: N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-(phenylsulfanyl)acetamide
Smiles: COc1cc(ccc1OC)c1nnc(s1)NC(=O)CSc1ccccc1

STL004282
Synonyms: (8xi,9xi,14xi)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl4-[(2-methylpropyl)amino]-4-oxobutanoate
Smiles: CC(CNC(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(O)C1C2CCC2=CC(=O)CC[C@]12C)C

STL004283
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dichlorophenyl)methylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1Cl)Cl

STL004284
Synonyms: N-[(2-hydroxyquinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-3-carboxamide
Smiles: Oc1nc2ccccc2cc1CN(c1ccccc1C)C(=O)c1cccnc1

STL004285
Synonyms: ethyl1-(4-bromophenyl)-5-(3-chloro-2-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1C)Cl)c1ccc(cc1)Br

STL004286
Synonyms: (12aS)-6-(3-bromophenyl)-2-[2-(2-fluorophenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Brc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccccc1F

STL004287
Synonyms: 2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(3-phenylpropyl)benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCCCc1ccccc1

STL004288
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(2E,3E)-4-[4-(dimethylamino)phenyl]but-3-en-2-ylidene}-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1C(C)C)c1nonc1N)/C=C/c1ccc(cc1)N(C)C

STL004289
Synonyms: 4-[(4-chlorophenyl)carbonyl]-3-hydroxy-5-(2-methoxyphenyl)-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccccc1C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(cc1)Cl)O

STL004290
Synonyms: 4-methyl-N-[2,4,6-trioxo-1-(2-phenylethyl)-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide
Smiles: Cc1ccc(cc1)C(=O)NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2CCc1ccccc1)C(F)(F)F

STL004291
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-hydroxyphenyl)methylidene]-5-propyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)O

STL004292
Synonyms: N-(3-chloro-4-fluorophenyl)-2-{(2E)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoacetamide
Smiles: O=C(C(=O)N/N=C(/c1ccco1)\C)Nc1ccc(c(c1)Cl)F

STL004293
Synonyms: N-(2,2,2-trichloro-1-{[2-(dimethylamino)ethyl]amino}ethyl)thiophene-2-carboxamide
Smiles: CN(CCNC(C(Cl)(Cl)Cl)NC(=O)c1cccs1)C

STL004294
Synonyms: N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-2-methoxy-N-(2-methylphenyl)benzamide
Smiles: COc1ccccc1C(=O)N(c1ccccc1C)Cc1cc2ccc(cc2nc1O)C

STL004295
Synonyms: 6-(4-benzylpiperazin-1-yl)-1,4-dimethyl-5-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)C)c(n(c1=O)C)N1CCN(CC1)Cc1ccccc1

STL004296
Synonyms: N-[(2-hydroxyquinolin-3-yl)methyl]-N-(4-methoxyphenyl)-3-methylbutanamide
Smiles: COc1ccc(cc1)N(C(=O)CC(C)C)Cc1cc2ccccc2nc1O

STL004297
Synonyms: 5-benzyl-3-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: O=C1C2ON(C(C2C(=O)N1Cc1ccccc1)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)c1ccccc1

STL004298
Synonyms: 8-bromo-7-(3-bromobenzyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1cccc(c1)Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

STL004299
Synonyms: 10a-{(E)-2-[3-methoxy-4-(propan-2-yloxy)phenyl]ethenyl}-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: COc1cc(ccc1OC(C)C)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1

STL004300
Synonyms: 8-(hexylsulfanyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCSc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STL004301
Synonyms: 1-[(6-chloropyridin-3-yl)sulfonyl]-4-methylpiperazine
Smiles: CN1CCN(CC1)S(=O)(=O)c1ccc(nc1)Cl

STL004302
Synonyms: N-[2-(2-{(Z)-[1-(2-fluorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-3-yl)ethyl]heptanamide
Smiles: CCCCCCC(=O)NCCc1c(/C=C\2/C(=O)NC(=S)N(C2=O)c2ccccc2F)[nH]c2c1cccc2

STL004303
Synonyms: methyl4-[(Z)-{2-[(2,3-dichlorophenyl)amino]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\SC(=NC1=O)Nc1cccc(c1Cl)Cl

STL004304
Synonyms: 6-methyl-3-[2-methyl-5-(pyrrolidin-1-ylsulfonyl)phenyl][1,2,4]triazolo[3,4-a]phthalazine
Smiles: Cc1ccc(cc1c1nnc2n1nc(C)c1c2cccc1)S(=O)(=O)N1CCCC1

STL004305
Synonyms: 5-(3-methylphenyl)-4-{[(E)-(3-methylthiophen-2-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Cc1cccc(c1)c1nnc(n1/N=C/c1sccc1C)S

STL004306
Synonyms: (5E)-1-benzyl-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C(=O)N1Cc1ccccc1

STL004307
Synonyms: 5-(4-bromophenyl)-4-[(4-bromophenyl)carbonyl]-1-(5-tert-butyl-1,2-oxazol-3-yl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: Brc1ccc(cc1)C1N(c2noc(c2)C(C)(C)C)C(=O)C(=C1C(=O)c1ccc(cc1)Br)O

STL004308
Synonyms: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(2-fluorobenzylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: Nc1nonc1n1nnc(c1CNc1ccccc1C(=O)N)C(=O)N/N=C/c1ccccc1F

STL004309
Synonyms: 8-[(2E)-2-(2,4-dihydroxybenzylidene)hydrazinyl]-7-(2-hydroxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C/c2ccc(cc2O)O)nc2c1c(=O)[nH]c(=O)n2C

STL004310
Synonyms: 3,3'-disulfanediylbis(tetrahydrothiophene)1,1,1',1'-tetraoxide
Smiles: O=S1(=O)CCC(C1)SSC1CCS(=O)(=O)C1

STL004311
Synonyms: 5-(4-tert-butylphenyl)-1-(furan-2-ylmethyl)-3-hydroxy-4-[(4-methylphenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)Cc1ccco1

STL004312
Synonyms: N-(2-chlorophenyl)-4-hydroxy-2-oxo-1-pentyl-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCCn1c(=O)c(C(=O)Nc2ccccc2Cl)c(c2c1cccc2)O

STL004313
Synonyms: 8-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-dimethyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2CCc1ccccc1)NCCCn1cncc1

STL004315
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(5-chlorothiophen-2-yl)ethylidene]-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(s1)/C(=N/NC(=O)c1nnn(c1c1cccs1)c1nonc1N)/C

STL004316
Synonyms: 1-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea
Smiles: CCCCOc1cccc(c1)c1nnc(s1)NC(=O)Nc1ccc(cc1)OCC

STL004317
Synonyms: N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-N-(3-methylphenyl)-4-nitrobenzamide
Smiles: Cc1cccc(c1)N(C(=O)c1ccc(cc1)[N+](=O)[O-])Cc1cc2ccc(cc2nc1O)C

STL004318
Synonyms: N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-2-[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]acetohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)Cn1c(nc2c1cccc2)c1ccccn1

STL004319
Synonyms: 6-(2,6-dimethylmorpholin-4-yl)-1,4-dimethyl-2-oxo-5-{(Z)-[4-oxo-3-(3-phenylpropyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCCc2ccccc2)c(n(c1=O)C)N1CC(C)OC(C1)C

STL004320
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-N'-[(E)-thiophen-3-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1cscc1

STL004321
Synonyms: 1-{4-[2-(diphenylmethoxy)ethoxy]-4-methylhex-2-yn-1-yl}piperidine
Smiles: CCC(C#CCN1CCCCC1)(OCCOC(c1ccccc1)c1ccccc1)C

STL004322
Synonyms: N-[2-(2-{(Z)-[1-(3-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-3-yl)ethyl]propanamide
Smiles: CCC(=O)NCCc1c(/C=C\2/C(=O)NC(=O)N(C2=O)c2cccc(c2)C)[nH]c2c1cccc2

STL004323
Synonyms: N-(3-fluorophenyl)-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Smiles: Fc1cccc(c1)Nc1nc(C)nc2c1c1CCCCc1s2

STL004324
Synonyms: 2-chloro-N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-N-(2-methoxyphenyl)benzamide
Smiles: COc1ccccc1N(C(=O)c1ccccc1Cl)Cc1cc2cccc(c2nc1O)C

STL004325
Synonyms: 3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-(2-fluorophenyl)-N-methyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Smiles: CNC(=S)N1N=C(CC1c1ccccc1F)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

STL004326
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Oc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N

STL004327
Synonyms: N-[4-(cyanomethyl)phenyl]-2-oxo-2-{(2E)-2-[1-(pyridin-4-yl)ethylidene]hydrazinyl}acetamide
Smiles: N#CCc1ccc(cc1)NC(=O)C(=O)N/N=C(/c1ccncc1)\C

STL004328
Synonyms: 4-(naphthalen-1-ylamino)-3-nitro-2H-chromen-2-one
Smiles: [O-][N+](=O)c1c(=O)oc2c(c1Nc1cccc3c1cccc3)cccc2

STL004329
Synonyms: (2E)-2-cyano-N-cyclopropyl-3-[1-(2-phenoxyethyl)-1H-indol-3-yl]prop-2-enamide
Smiles: N#C/C(=C\c1cn(c2c1cccc2)CCOc1ccccc1)/C(=O)NC1CC1

STL004330
Synonyms: 9-(3,4-dimethylphenyl)-1,7-dimethyl-3-pentyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(c(c1)C)C

STL004331
Synonyms: (3E,8xi,14xi,17xi)-3-(2-carbamothioylhydrazinylidene)-14-hydroxycard-20(22)-enolide
Smiles: NC(=S)N/N=C/1\CC[C@]2(C(C1)CCC1[C@@H]2CC[C@]2(C1(O)CCC2C1=CC(=O)OC1)C)C

STL004332
Synonyms: ethyl5-(4-bromophenyl)-4,6-dioxo-1-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1

STL004333
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(2,4-dichlorophenyl)ethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(c(c1)Cl)/C(=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)/C

STL004334
Synonyms: 4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(3-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1cccc(c1)c1nnc(n1/N=C/c1ccc(c(c1)Br)OC)S

STL004335
Synonyms: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3,4-dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1nnc(s1)c1ccc(cc1)Cl

STL004336
Synonyms: 9a-[(E)-2-(2,3-dichlorophenyl)ethenyl]-9,9-dimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: O=C1CN2C(N1)(/C=C/c1cccc(c1Cl)Cl)C(c1c2cccc1)(C)C

STL004337
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(5-methylfuran-2-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(o1)C

STL004338
Synonyms: 4-{[(E)-(5-bromo-2-methoxyphenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1)c1nnc(n1/N=C/c1cc(Br)ccc1OC)S

STL004339
Synonyms: 2-{8-[(diethylamino)methyl]-3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl}ethyl3,4,5-trimethoxybenzoate
Smiles: CCN(Cc1nc2c(n1C)c(=O)n(c(=O)n2C)CCOC(=O)c1cc(OC)c(c(c1)OC)OC)CC

STL004340
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(2-methoxyphenyl)ethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccccc1/C(=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)/C

STL004341
Synonyms: 8-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]-7-(2-hydroxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C/c2ccc(cc2)F)nc2c1c(=O)[nH]c(=O)n2C

STL004342
Synonyms: 2-methyl-5-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}-1,3,4-thiadiazole
Smiles: Cc1nnc(s1)Sc1ccc(cc1[N+](=O)[O-])C(F)(F)F

STL004343
Synonyms: (5Z)-5-(4-ethylbenzylidene)-2-[4-(2-methylphenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: CCc1ccc(cc1)/C=C/1\SC(=NC1=O)N1CCN(CC1)c1ccccc1C

STL004344
Synonyms: 5-bromo-N'-(6,7-dimethoxy-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)furan-2-carbohydrazide
Smiles: COc1cc2C(=NC(Cc2cc1OC)(C)C)NNC(=O)c1ccc(o1)Br

STL004345
Synonyms: 1,4-dimethyl-5-{(Z)-[3-(4-methylbenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-6-(4-methylpiperazin-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)Cc2ccc(cc2)C)c(n(c1=O)C)N1CCN(CC1)C

STL004346
Synonyms: 3-{3-[(3,4-dimethylphenyl)amino]imidazo[1,2-a]pyridin-2-yl}-6-methoxyquinolin-2-ol
Smiles: COc1ccc2c(c1)cc(c(n2)O)c1nc2n(c1Nc1ccc(c(c1)C)C)cccc2

STL004347
Synonyms: 3-(4-fluorobenzyl)-9-(3-methoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cccc(c1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)F

STL004348
Synonyms: 2-[(E)-2-(3-methylphenyl)ethenyl]quinoline
Smiles: Cc1cccc(c1)/C=C/c1ccc2c(n1)cccc2

STL004349
Synonyms: (5E)-5-({[2-(diethylamino)ethyl]amino}methylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN(CCN/C=C/1\C(=O)NC(=S)N(C1=O)c1ccccc1)CC

STL004350
Synonyms: 8-[(4-chlorophenyl)sulfanyl]-7-(2,4-dichlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)Sc1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)n(c(=O)n2C)C

STL004351
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-chlorophenyl)methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)Cl)C

STL004352
Synonyms: N'-[(E)-(1-hexyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]pentanehydrazide
Smiles: CCCCCCN1C(=O)NC(=O)/C(=C\NNC(=O)CCCC)/C1=O

STL004353
Synonyms: N-{4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1ccc(cc1)C)c1nonc1N

STL004354
Synonyms: 4-fluoro-N-[5-(1H-indol-3-ylmethyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1nnc(s1)Cc1c[nH]c2c1cccc2

STL004355
Synonyms: 10a-[(E)-2-{3-methoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: COc1cc(ccc1OCC(=C)C)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1

STL004356
Synonyms: 3-(3-chlorobenzyl)-9-(4-ethylphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cccc(c1)Cl

STL004357
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/C=C/c1ccccc1

STL004358
Synonyms: (4S)-6-amino-4-(2-chloro-5-nitrophenyl)-1-(3-chlorophenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c([C@H]1c1cc(ccc1Cl)[N+](=O)[O-])c(C)nn2c1cccc(c1)Cl

STL004359
Synonyms: tert-butyl{(2S)-4-(methylsulfanyl)-1-oxo-1-[(2E)-2-(quinolin-6-ylmethylidene)hydrazinyl]butan-2-yl}carbamate(non-preferredname)
Smiles: CSCC[C@@H](C(=O)N/N=C/c1ccc2c(c1)cccn2)NC(=O)OC(C)(C)C

STL004360
Synonyms: (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one
Smiles: COc1ccc(cc1)C(=O)/C=C\1/NCCNC1=O

STL004361
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-phenylethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/c1ccccc1

STL004362
Synonyms: N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-3,4,5-trimethoxy-N-(2-methoxyphenyl)benzamide
Smiles: COc1ccccc1N(C(=O)c1cc(OC)c(c(c1)OC)OC)Cc1cc2ccc(cc2nc1O)C

STL004364
Synonyms: 3-butyl-9-(3-methoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cccc(c1)OC

STL004365
Synonyms: 4-{(Z)-[2-(3-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-methoxyphenylethylcarbonate
Smiles: CCOC(=O)Oc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1cccc(c1)Cl

STL004366
Synonyms: 6-(4-fluorophenyl)-7-(4-methylphenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nn2c(n1)NC1=C(C2c2ccc(cc2)C)C(Oc2c1cccc2)c1ccc(cc1)F

STL004367
Synonyms: 3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-[(4-methoxyphenyl)carbonyl]-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1O)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(cc1)OC)O

STL004368
Synonyms: 4-{(Z)-[2-(2,5-dichlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2,6-dimethoxyphenylacetate
Smiles: COc1cc(/C=C/2\N=C(OC2=O)c2cc(Cl)ccc2Cl)cc(c1OC(=O)C)OC

STL004369
Synonyms: 7-(4-ethylphenyl)-8-(2-methoxy-4-methylphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCc1ccc(cc1)c1cn2c(n1c1ccc(cc1OC)C)nc1c2c(=O)n(C)c(=O)n1C

STL004370
Synonyms: tert-butyl{(2R)-1-[(2E)-2-(2H-chromen-3-ylmethylidene)hydrazinyl]-3-methyl-1-oxobutan-2-yl}carbamate(non-preferredname)
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)N/N=C/C1=Cc2c(OC1)cccc2)C(C)C

STL004371
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dichlorophenyl)-N'-[(1E)-1-(3-methoxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1)/C(=N/NC(=O)c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)/C

STL004372
Synonyms: 10a-[(E)-2-(biphenyl-4-yl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: O=C1CCN2C(N1)(/C=C/c1ccc(cc1)c1ccccc1)C(C)(C)c1c2cccc1

STL004373
Synonyms: 9-(3,4-dimethylphenyl)-1,7-dimethyl-3-(3-methylbutyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC(CCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(c(c1)C)C)C

STL004374
Synonyms: N-[2-(2-{(Z)-[1-(4-chlorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-3-yl)ethyl]acetamide
Smiles: CC(=O)NCCc1c(/C=C\2/C(=O)NC(=S)N(C2=O)c2ccc(cc2)Cl)[nH]c2c1cccc2

STL004375
Synonyms: (2E)-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)prop-2-enamide
Smiles: COc1ccc(cc1)/C=C/C(=O)Nc1nnc(s1)c1ccc(c(c1)OC)OC

STL004376
Synonyms: N-benzyl-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)NCc2ccccc2)c2c(n1)c1ccccc1o2

STL004377
Synonyms: ethyl[(7-butyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetate
Smiles: CCCCn1c(SCC(=O)OCC)nc2c1c(=O)[nH]c(=O)n2C

STL004378
Synonyms: 2-chloro-7-(4-fluorophenyl)-10-(methylsulfanyl)-6-(thiophen-2-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nn2c(n1)NC1=C(C2c2ccc(cc2)F)C(Oc2c1cc(Cl)cc2)c1cccs1

STL004379
Synonyms: N-({4-[(E)-{2-[(2E)-2-(4-hydroxy-3-methoxybenzylidene)hydrazinyl]-4-phenyl-1,3-selenazol-5-yl}diazenyl]phenyl}sulfonyl)acetamide
Smiles: COc1cc(/C=N/Nc2[se]c(c(n2)c2ccccc2)/N=N/c2ccc(cc2)S(=O)(=O)NC(=O)C)ccc1O

STL004380
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-1-[(2-fluorobenzyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccccc1F)C(C)C)NC(=O)OC(C)(C)C

STL004381
Synonyms: 5-ethyl-6-(3,4,5-trimethoxyphenyl)-5,6-dihydrobenzimidazo[1,2-c]quinazoline
Smiles: CCN1c2ccccc2c2n(C1c1cc(OC)c(c(c1)OC)OC)c1ccccc1n2

STL004382
Synonyms: 7-(2-hydroxy-3-phenoxypropyl)-8-[(3-methoxypropyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCCNc1nc2c(n1CC(COc1ccccc1)O)c(=O)[nH]c(=O)n2C

STL004383
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CSc2ccccc2)c2nonc2N)ccc1O

STL004384
Synonyms: 7-(4-methoxyphenyl)-5,6,8,9-tetrahydrodibenzo[c,h]acridine
Smiles: COc1ccc(cc1)c1c2CCc3c(c2nc2c1CCc1c2cccc1)cccc3

STL004385
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-(2-methoxynaphthalen-1-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc2c(c1/C=N/NC(=O)c1nnn(c1CN(C)C)c1nonc1N)cccc2

STL004386
Synonyms: 4-(acetylamino)-1-[2-(3-nitrophenyl)-2-oxoethyl]pyridinium
Smiles: CC(=O)Nc1cc[n+](cc1)CC(=O)c1cccc(c1)[N+](=O)[O-]

STL004387
Synonyms: 1-(4-ethoxyphenyl)-5-(2-fluorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1F)C(=O)c1ccccc1)O

STL004388
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-naphthalen-1-ylmethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1cccc2c1cccc2

STL004390
Synonyms: 8-{[benzyl(methyl)amino]methyl}-7-(2-methoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(CN(Cc2ccccc2)C)nc2c1c(=O)n(c(=O)n2C)C

STL004391
Synonyms: ethyl5-(3,5-dimethylphenyl)-1-nitroso-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cc(C)cc(c1)C)N=O

STL004392
Synonyms: 6-methyl-3-(4-methylphenyl)[1,2,4]triazolo[3,4-a]phthalazine
Smiles: Cc1ccc(cc1)c1nnc2n1nc(C)c1c2cccc1

STL004393
Synonyms: 4-[3-(6-bromo-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1cc(ccc1OC)C1CC(=NN1C(=O)CCC(=O)O)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Br

STL004394
Synonyms: N-(3-methoxyphenyl)-2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: COc1cccc(c1)Nc1nc(nc2c1oc1c2cccc1)c1ccccc1

STL004395
Synonyms: 5-(3-methylphenyl)-4-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Smiles: Cc1cccc(c1)c1nnc(n1/N=C/c1ccc(cc1)C(C)C)S

STL004396
Synonyms: 2-{4-[(1E)-1-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-propyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]phenoxy}acetamide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)OCC(=O)N)\C

STL004397
Synonyms: 9-(3,4-dimethylphenyl)-3-(2-methoxyethyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(c(c1)C)C

STL004400
Synonyms: 4-[(4-bromophenyl)carbonyl]-1-(5-tert-butyl-1,2-oxazol-3-yl)-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1N(c2noc(c2)C(C)(C)C)C(=O)C(=C1C(=O)c1ccc(cc1)Br)O

STL004401
Synonyms: N'-[(E)-(4-bromothiophen-2-yl)methylidene]-1-methyl-1H-indole-3-carbohydrazide
Smiles: Brc1csc(c1)/C=N/NC(=O)c1cn(c2c1cccc2)C

STL004402
Synonyms: 9-(3,5-dimethylphenyl)-1,7-dimethyl-3-(2-methylpropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cc(C)cc(c1)C)C

STL004403
Synonyms: 4-[(E)-{2-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]hydrazinylidene}methyl]-2-methoxyphenylfuran-2-carboxylate
Smiles: COc1cc(/C=N/NC(=O)Cn2nc(c(c2C)Br)C)ccc1OC(=O)c1ccco1

STL004404
Synonyms: 1-(3-phenylprop-2-yn-1-yl)-1-(prop-2-yn-1-yl)pyrrolidinium
Smiles: C#CC[N+]1(CCCC1)CC#Cc1ccccc1

STL004405
Synonyms: 4-{[(E)-(3-fluorophenyl)methylidene]amino}-5-(3-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/c1cccc(c1)F)S

STL004406
Synonyms: ethyl5-acetyl-2-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc3c(c2)OCO3)/C#N)sc(c1C)C(=O)C

STL004407
Synonyms: 3-(4-chlorobenzyl)-9-(4-ethoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)Cl

STL004408
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-methoxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N

STL004410
Synonyms: benzyl[1-methyl-9-(4-methylphenyl)-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Smiles: O=C(Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)C)OCc1ccccc1

STL004411
Synonyms: 1-[2-(dimethylamino)ethyl]-4-(furan-2-ylcarbonyl)-3-hydroxy-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(cc(c1OC)OC)C1N(CCN(C)C)C(=O)C(=C1C(=O)c1ccco1)O

STL004412
Synonyms: 6-(5-tert-butyl-2-hydroxyphenyl)-1,3-dimethyl-5-(4-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Cc1ccc(cc1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1cc(ccc1O)C(C)(C)C

STL004413
Synonyms: N-[2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide
Smiles: O=C(Nc1cc(ccc1C)c1nnc2n1nc(C)c1c2cccc1)COc1ccc(cc1)C

STL004414
Synonyms: diethyl5-({(Z)-2-cyano-2-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2cccs2)/C#N)sc(c1C)C(=O)OCC

STL004415
Synonyms: N-(2,6-difluorophenyl)-2-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: O=C(Nc1c(F)cccc1F)CSc1nc(C)nc2c1oc1c2cccc1

STL004416
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-N'-[(E)-thiophen-3-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1cscc1

STL004417
Synonyms: (12bS)-7-(2-chlorophenyl)-2-(2,2-dimethoxyethyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COC(CN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1C(C2)c1ccccc1Cl)cccc3)OC

STL004418
Synonyms: ethyl4-{5-cyano-1,4-dimethyl-6-oxo-3-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,6-dihydropyridin-2-yl}piperazine-1-carboxylate
Smiles: CCCCCN1C(=S)S/C(=C\c2c(C)c(C#N)c(=O)n(c2N2CCN(CC2)C(=O)OCC)C)/C1=O

STL004419
Synonyms: 8-[(2-aminoethyl)amino]-7-(2,4-dichlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: NCCNc1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)n(c(=O)n2C)C

STL004420
Synonyms: N-[3-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]benzamide
Smiles: O=C(c1ccccc1)Nc1cccc(c1)c1nnc2n1nc(C)c1c2cccc1

STL004422
Synonyms: 2-[(E)-(5-cyano-2-hydroxy-4-methyl-6-oxo-1,6-dihydropyridin-3-yl)diazenyl]benzoicacid
Smiles: N#Cc1c(=O)[nH]c(c(c1C)/N=N/c1ccccc1C(=O)O)O

STL004423
Synonyms: 4-{[(E)-(2,6-dichlorophenyl)methylidene]amino}-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1c(Cl)cccc1Cl)c1ccccn1

STL004424
Synonyms: (5E)-5-{[(2,3-dimethylcyclohexyl)amino]methylidene}-1-ethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=S)NC(=O)/C(=C\NC2CCCC(C2C)C)/C1=O

STL004425
Synonyms: 2,2'-{ethane-1,2-diylbis[nitrilo(E)methylylidene]}bis(4,6-di-tert-butylphenol)
Smiles: Oc1c(/C=N/CC/N=C/c2cc(cc(c2O)C(C)(C)C)C(C)(C)C)cc(cc1C(C)(C)C)C(C)(C)C

STL004426
Synonyms: 4-[5-(naphthalen-1-yl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1cccc2c1cccc2)c1ccccc1

STL004428
Synonyms: N-(2-bromophenyl)-4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxamide
Smiles: Brc1ccccc1NC(=O)C12CCC(C2(C)C)(c2c1nc1ccccc1n2)C

STL004429
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccc(cc2)C)c2nonc2N)ccc1OC

STL004430
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-1-[(2-methoxybenzyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccccc1OC)C(C)C)NC(=O)OC(C)(C)C

STL004431
Synonyms: N'-[(E)-(1-methyl-4,6-dioxo-3-phenyl-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]pyridine-4-carbohydrazide
Smiles: S=C1N(C)C(=O)/C(=C\NNC(=O)c2ccncc2)/C(=O)N1c1ccccc1

STL004432
Synonyms: 4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1cc(ccc1Cl)[N+](=O)[O-])c1ccccn1

STL004433
Synonyms: 1-[3-(diethylamino)propyl]-3-hydroxy-4-[(4-methylphenyl)carbonyl]-5-(pyridin-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCN(CCCN1C(c2ccccn2)C(=C(C1=O)O)C(=O)c1ccc(cc1)C)CC

STL004434
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dichlorophenyl)-N'-[(1E)-1-(2-ethoxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccccc1/C(=N/NC(=O)c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)/C

STL004435
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-methylthiophen-2-yl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1sccc1C

STL004436
Synonyms: 1-(1,3-benzodioxol-5-yl)-2-hydroxy-2-(4-methylphenyl)-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium
Smiles: Cc1ccc(cc1)C1(O)CN2C(=[N+]1c1ccc3c(c1)OCO3)CCCCC2

STL004437
Synonyms: (4Z)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-(2,4-dichlorophenyl)-1,3-oxazol-5(4H)-one
Smiles: Clc1ccc(c(c1)Cl)C1=N/C(=C\c2cc3OCOc3cc2Br)/C(=O)O1

STL004438
Synonyms: 4,6-bis(4-methoxyphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]pyridine-3-carbonitrile
Smiles: COc1ccc(cc1)c1nc(SCC(=O)c2ccccc2)c(c(c1)c1ccc(cc1)OC)C#N

STL004439
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-bromo-4,5-dimethoxyphenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2C(C)C)c2nonc2N)c(cc1OC)Br

STL004440
Synonyms: N-(2,4-dichlorophenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)Nc2ccc(cc2Cl)Cl)c2c(n1)c1ccccc1o2

STL004441
Synonyms: 3-(2,5-dimethoxyphenyl)-5-{[1-(2,5-dimethoxyphenyl)-6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl][4-methoxy-3-(piperidinium-1-ylmethyl)phenyl]methyl}-6-oxo-2-thioxo-1,2,3,6-tetrahydropyri
Smiles: COc1ccc(c(c1)n1c(=S)[nH]c(=O)c(c1[O-])C(c1c(=O)[nH]c(=S)n(c1O)c1cc(OC)ccc1OC)c1ccc(c(c1)C[NH+]1CCCCC1)OC)OC

STL004442
Synonyms: (5Z)-2-[(4-hydroxyphenyl)amino]-5-(4-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1ccc(cc1)/C=C/1\SC(=NC1=O)Nc1ccc(cc1)O

STL004443
Synonyms: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(2-ethoxybenzylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: CCOc1ccccc1/C=N/NC(=O)c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N

STL004444
Synonyms: 9-(3-methoxyphenyl)-1,7-dimethyl-3-pentyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cccc(c1)OC

STL004445
Synonyms: 3-amino-6-ethyl-N-[2-(4-methoxyphenyl)ethyl]-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)NCCc1ccc(cc1)OC

STL004446
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N'-[(E)-(2-methoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1OC

STL004447
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-bromophenyl)ethylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)Br)\C

STL004448
Synonyms: 8-(azepan-1-yl)-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCSc1nnnn1c1ccccc1)c(n2)N1CCCCCC1)C

STL004449
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(cyclopentyloxy)-3-methoxyphenyl]methylidene}-5-propyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(c(c1)OC)OC1CCCC1

STL004450
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-cyclohexylphenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C(/c1ccc(cc1)C1CCCCC1)\C

STL004451
Synonyms: 9-(3-methoxyphenyl)-1,7-dimethyl-3-propyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cccc(c1)OC

STL004452
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/C(=C/c1ccco1)/C

STL004453
Synonyms: 3-butyl-9-(3,4-dimethylphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(c(c1)C)C

STL004454
Synonyms: N'-[(2E)-butan-2-ylidene]-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CC/C(=N/NC(=O)c1c(O)c2ccccc2n(c1=O)C)/C

STL004457
Synonyms: N-(3-chloro-4-methylphenyl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)Nc1ccc(c(c1)Cl)C

STL004458
Synonyms: N-(2,4-dimethylphenyl)-N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-3,4,5-trimethoxybenzamide
Smiles: COc1c(OC)cc(cc1OC)C(=O)N(c1ccc(cc1C)C)Cc1cc2cccc(c2nc1O)C

STL004459
Synonyms: ethyl[9-(3,4-dimethylphenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Smiles: CCOC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(c(c1)C)C

STL004460
Synonyms: N-(3,4-dichlorophenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)Nc2ccc(c(c2)Cl)Cl)c2c(n1)c1ccccc1o2

STL004461
Synonyms: 9-(4-ethoxyphenyl)-1,7-dimethyl-3-pentyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCn1c(=O)c2n3CC(C)CN(c3nc2n(c1=O)C)c1ccc(cc1)OCC

STL004462
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dichlorophenyl)-N'-[(1E)-1-(4-ethoxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)/C

STL004463
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N'-[(3Z)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C1Nc2c(/C/1=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N)cccc2

STL004464
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-methoxyphenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1N

STL004465
Synonyms: N-[1-(3,4-dimethylphenyl)-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]pyridine-3-carboxamide
Smiles: O=C(c1cccnc1)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)c1ccc(c(c1)C)C)C(F)(F)F

STL004466
Synonyms: 7-(4-chlorophenyl)-8-(2,5-dimethylphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(cc1)c1cn2c(n1c1cc(C)ccc1C)nc1c2c(=O)n(C)c(=O)n1C

STL004467
Synonyms: 9-(3-methoxyphenyl)-1-methyl-3-pentyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)OC

STL004468
Synonyms: N'-[(E)-(3-bromophenyl)methylidene]-2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1cccc(c1)Br

STL004469
Synonyms: {2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiophen-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccccc1/C=N/NC(=O)c1nnn(c1c1cccs1)c1nonc1N

STL004470
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(naphthalen-1-yl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C(/c1cccc2c1cccc2)\C

STL004471
Synonyms: 1-(4-chlorophenyl)-4-(4-methoxyphenyl)-N-propyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCCNC(=O)c1c(c2ccc(cc2)Cl)c2c3n1cc(n3CCCC2)c1ccc(cc1)OC

STL004472
Synonyms: 9-(4-ethoxyphenyl)-3-(4-fluorobenzyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)F

STL004473
Synonyms: 1-(1H-benzimidazol-1-yl)-3-(naphthalen-1-yloxy)propan-2-ol
Smiles: OC(Cn1cnc2c1cccc2)COc1cccc2c1cccc2

STL004474
Synonyms: ethyl[3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]acetate
Smiles: CCOC(=O)CN1C(c2ccc(c(c2)OC)OC)C(=C(C1=O)O)C(=O)C

STL004475
Synonyms: 8-benzyl-1-[(2-chlorobenzyl)sulfanyl]-4-ethyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCn1c(=O)c2c3CCN(Cc3sc2n2c1nnc2SCc1ccccc1Cl)Cc1ccccc1

STL004476
Synonyms: 4-[4-(5-chloro-2-methoxybenzyl)piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide
Smiles: COc1ccc(cc1CN1CCN(CC1)C(=O)CCC(=O)Nc1nnc(s1)CC(C)C)Cl

STL004477
Synonyms: methyl7-(3,4-dimethylphenyl)-1-nitroso-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Smiles: O=NN1N=C(CC21CC(=O)N(C2=O)c1ccc(c(c1)C)C)C(=O)OC

STL004478
Synonyms: 7-butyl-8-{(2E)-2-[1-(4-hydroxyphenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCn1c(N/N=C(/c2ccc(cc2)O)\C)nc2c1c(=O)[nH]c(=O)n2C

STL004479
Synonyms: ethyl2-{2-(4-tert-butylphenyl)-4-hydroxy-3-[(5-methylfuran-2-yl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)C(C)(C)C)C(=C(C1=O)O)C(=O)c1ccc(o1)C

STL004480
Synonyms: 3-(4-fluorophenyl)-1-(pyridin-2-ylmethoxy)quinoxalin-2(1H)-one4-oxide
Smiles: Fc1ccc(cc1)c1c(=O)n(OCc2ccccn2)c2c([n+]1[O-])cccc2

STL004481
Synonyms: 1-[3-(dimethylamino)propyl]-3-hydroxy-5-(3-methoxyphenyl)-4-{[4-(propan-2-yloxy)phenyl]carbonyl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cccc(c1)C1N(CCCN(C)C)C(=O)C(=C1C(=O)c1ccc(cc1)OC(C)C)O

STL004482
Synonyms: 5-(2-chlorophenyl)-4-({(E)-[4-(trifluoromethyl)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1ccc(cc1)C(F)(F)F)c1ccccc1Cl

STL004483
Synonyms: methyl4-{5-[(E)-{2-[(5-amino-1,3,4-thiadiazol-2-yl)acetyl]hydrazinylidene}methyl]furan-2-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)c1ccc(o1)/C=N/NC(=O)Cc1nnc(s1)N

STL004484
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-chlorophenyl)methylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1Cl

STL004486
Synonyms: 4-(1-benzofuran-2-ylcarbonyl)-3-hydroxy-5-(3-methoxy-4-propoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCOc1ccc(cc1OC)C1N(c2noc(c2)C)C(=O)C(=C1C(=O)c1cc2c(o1)cccc2)O

STL004487
Synonyms: 8-[benzyl(methyl)amino]-7-hexyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(Cc1ccccc1)C

STL004488
Synonyms: N'-[(E)-biphenyl-4-ylmethylidene]-2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1ccc(cc1)c1ccccc1

STL004489
Synonyms: 1-(4-ethoxyphenyl)-3-{5-[(4-ethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}urea
Smiles: CCOc1ccc(cc1)NC(=O)Nc1nnc(s1)COc1ccc(cc1)CC

STL004490
Synonyms: 9-(4-ethoxyphenyl)-1-methyl-3-(2-methylprop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CC(=C)C

STL004491
Synonyms: 2-(2,4-dimethoxyphenyl)-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1cc(OC)ccc1c1nn2c(n1)c1cnn(c1nc2)c1ccccc1

STL004492
Synonyms: 6'-amino-3'-methyl-1-(3-methylbutyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31C(=O)N(c1c3cccc1)CCC(C)C)c(C)n[nH]2

STL004493
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]-5-[(diethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)CC

STL004495
Synonyms: 9-(3-methoxyphenyl)-1,7-dimethyl-3-(naphthalen-1-ylmethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cccc(c1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cccc2c1cccc2

STL004496
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-{(E)-[4-(propan-2-yl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)C(C)C

STL004497
Synonyms: 6-(3-fluorophenyl)-1,3-dimethyl-5-(4-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Cc1ccc(cc1)c1n(cc2c1c(=O)n(C)c(=O)n2C)c1cccc(c1)F

STL004498
Synonyms: (5E)-1-butyl-5-({[3-(dimethylamino)propyl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCCCN1C(=O)NC(=O)/C(=C\NCCCN(C)C)/C1=O

STL004499
Synonyms: 6-chloro-2-[5-(3,4-dimethoxyphenyl)-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-phenylquinazoline
Smiles: COc1cc(ccc1OC)C1CC(=NN1c1nc2ccc(cc2c(n1)c1ccccc1)Cl)c1ccco1

STL004500
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-3-methyl-1-[(4-methylphenyl)amino]-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)C)C(C)C)NC(=O)OC(C)(C)C

STL004501
Synonyms: N-[(1Z)-3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-3-oxo-1-phenylprop-1-en-2-yl]-3-bromobenzamide
Smiles: Brc1cccc(c1)C(=O)N/C(=C\c1ccccc1)/C(=O)NCCc1nc2c([nH]1)cccc2

STL004502
Synonyms: 1-(4-ethoxyphenyl)-3-hydroxy-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)N1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)/C=C/c1ccccc1

STL004503
Synonyms: N-[4-(acetylamino)phenyl]-2-{[3-(4-chlorophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCCC3

STL004504
Synonyms: 9-(4-ethylphenyl)-3-(4-fluorobenzyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)F

STL004505
Synonyms: N'-[(E)-(3-methoxyphenyl)methylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2cccc(c2)OC)nc2c(c1=O)cccc2

STL004506
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-N'-{(E)-[4-(propan-2-yl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1ccc(cc1)C(C)C

STL004507
Synonyms: ethyl5-(3,5-dichlorophenyl)-1-nitroso-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl)N=O

STL004508
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-chlorophenyl)-N'-[(E)-(2,3-dichlorophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccccc1Cl)c1nonc1N)N/N=C/c1cccc(c1Cl)Cl

STL004509
Synonyms: N'-[(E)-(4-methylphenyl)methylidene]-2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1C)N/N=C/c1ccc(cc1)C

STL004510
Synonyms: (2E)-2-cyano-N-cyclohexyl-3-{[3-(1H-imidazol-1-yl)propyl]amino}but-2-enamide
Smiles: N#C/C(=C(\NCCCn1cncc1)/C)/C(=O)NC1CCCCC1

STL004511
Synonyms: (5Z)-5-{[1-(3-chloropropyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-1-[4-(propan-2-yl)phenyl]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: ClCCCN1CCc2c1ccc(c2)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)C(C)C

STL004512
Synonyms: ethyl4-{5-cyano-3-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-6-oxo-1,6-dihydropyridin-2-yl}piperazine-1-carboxylate
Smiles: CCCCCCN1C(=S)S/C(=C\c2c(C)c(C#N)c(=O)n(c2N2CCN(CC2)C(=O)OCC)C)/C1=O

STL004513
Synonyms: N-cyclohexyl-4-(4-fluorophenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)c1c(C(=O)NC2CCCCC2)n2c3c1CCCCn3c(c2)c1ccc(cc1)F

STL004514
Synonyms: 7-(2-hydroxyethyl)-3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C(/c2ccc(cc2)[N+](=O)[O-])\C)nc2c1c(=O)[nH]c(=O)n2C

STL004515
Synonyms: 2'-(2,4-dimethoxyphenyl)-1-(methylsulfonyl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: COc1ccc(c(c1)OC)C1=NN2C(C1)c1ccccc1OC12CCN(CC1)S(=O)(=O)C

STL004516
Synonyms: 4-butyl-6-chloro-2-oxo-2H-chromen-7-ylN-(tert-butoxycarbonyl)norvalinate
Smiles: CCCC(C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)CCCC)NC(=O)OC(C)(C)C

STL004518
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-methoxynaphthalen-1-yl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc2c(c1/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)cccc2

STL004519
Synonyms: N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-N-(3-methoxyphenyl)-3-nitrobenzamide
Smiles: COc1cccc(c1)N(C(=O)c1cccc(c1)[N+](=O)[O-])Cc1cc2cccc(c2nc1O)C

STL004520
Synonyms: 1,7-dimethyl-3-(4-methylbenzyl)-9-(3-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1ccc(cc1)Cn1c(=O)c2n3CC(C)CN(c3nc2n(c1=O)C)c1cccc(c1)C

STL004521
Synonyms: (5E)-5-({[2-(4-methoxyphenyl)ethyl]amino}methylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1)CCN/C=C/1\C(=O)NC(=O)N(C1=O)C

STL004522
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(1E)-1-(3-chlorophenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1cccc(c1)/C(=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)/C

STL004523
Synonyms: N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(2-methylphenyl)benzamide
Smiles: Cc1ccc2c(c1)cc(c(n2)O)CN(c1ccccc1C)C(=O)c1ccccc1

STL004524
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2C(C)C)c2nonc2N)cccc1OC

STL004525
Synonyms: 4-[5-({2-[(4-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-1H-tetrazol-1-yl]benzamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnnn1c1ccc(cc1)C(=O)N

STL004526
Synonyms: 8-[(2E)-2-(4-hydroxybenzylidene)hydrazinyl]-3-methyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(N/N=C/c2ccc(cc2)O)nc2c1c(=O)[nH]c(=O)n2C

STL004527
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-{(E)-[3-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)C(F)(F)F

STL004528
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dimethoxyphenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(OC)ccc1/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N

STL004529
Synonyms: {4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-propyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenoxy}aceticacid
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)OCC(=O)O

STL004530
Synonyms: [3-hydroxy-5-(4-methylphenyl)-2-oxo-4-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]aceticacid
Smiles: OC(=O)CN1C(c2ccc(cc2)C)C(=C(C1=O)O)C(=O)c1ccccc1

STL004531
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(3-bromophenyl)ethylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1cccc(c1)Br)\C

STL004532
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(4-methoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1)/C=N/n1c(S)nnc1c1ccccc1Cl

STL004533
Synonyms: 1-methyl-3-(2-methylpropyl)-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccccc1)C

STL004534
Synonyms: 1-methyl-9-(3-methylphenyl)-3-propyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)C

STL004535
Synonyms: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-1-(4-fluorobenzyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Fc1ccc(cc1)CN1C(=O)NC(=O)/C(=C\c2ccc3c(c2)OCO3)/C1=O

STL004536
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-(4-methylphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1ccc(cc1)C

STL004538
Synonyms: 5-({[2-(diethylamino)ethyl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN(CCNC=C1C(=O)NC(=S)NC1=O)CC

STL004539
Synonyms: 2-(4-ethylphenoxy)-N-[5-(2-methoxyphenyl)-1,3,4-thiadiazol-2-yl]acetamide
Smiles: CCc1ccc(cc1)OCC(=O)Nc1nnc(s1)c1ccccc1OC

STL004540
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Oc1ccc(c(c1)O)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N

STL004541
Synonyms: 6-(4-ethylpiperazin-1-yl)-5-[(Z)-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: CCN1CCN(CC1)c1c(/C=C/2\SC(=S)N(C2=O)CCc2ccc(cc2)OC)c(C)c(c(=O)n1C)C#N

STL004542
Synonyms: 8-[(2E)-2-(5-bromo-2-hydroxybenzylidene)hydrazinyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(c(c1)/C=N/Nc1nc2c(n1C)c(=O)[nH]c(=O)n2C)O

STL004543
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(4-ethylphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)CC

STL004544
Synonyms: 5-(4-ethoxyphenyl)-4-{[(1E,2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1)c1nnc(n1/N=C/C=C/c1ccccc1OC)S

STL004545
Synonyms: 5-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-6-(morpholin-4-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: CCCCCCN1C(=S)S/C(=C\c2c(N3CCOCC3)n(C)c(=O)c(c2C)C#N)/C1=O

STL004546
Synonyms: N'-[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/C(=C/c2ccccc2)/Cl)nc2c(c1=O)cccc2

STL004547
Synonyms: 5-(4-tert-butylphenyl)-6-(2-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: COc1ccccc1n1cc2c(c1c1ccc(cc1)C(C)(C)C)c(=O)n(c(=O)n2C)C

STL004548
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)OCc1c(F)cccc1Cl)C

STL004549
Synonyms: 3,4-dimethoxy-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: COc1cccc(c1)c1nnc(s1)NC(=O)c1ccc(c(c1)OC)OC

STL004550
Synonyms: 4-{[(E)-anthracen-9-ylmethylidene]amino}-5-(3-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1cccc(c1)c1nnc(n1/N=C/c1c2ccccc2cc2c1cccc2)S

STL004551
Synonyms: 5-{(6-hydroxy-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydropyrimidin-5-yl)[4-methoxy-3-(pyrrolidinium-1-ylmethyl)phenyl]methyl}-2,6-dioxo-1-phenyl-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccc(cc1C[NH+]1CCCC1)C(c1c(O)[nH]c(=O)n(c1=O)c1ccccc1)c1c([O-])[nH]c(=O)n(c1=O)c1ccccc1

STL004552
Synonyms: N-(4-cyanophenyl)-2-[(2E)-2-(4-methoxy-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzylidene)hydrazinyl]-2-oxoacetamide
Smiles: COc1ccc(cc1CSc1nnc(s1)C)/C=N/NC(=O)C(=O)Nc1ccc(cc1)C#N

STL004553
Synonyms: 9-(4-ethylphenyl)-1-methyl-3-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STL004554
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dichlorophenyl)-N'-[(1E)-2,3-dihydro-1H-inden-1-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)N/N=C/1\CCc2c1cccc2

STL004555
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(4-fluorobenzyl)oxy]phenyl}methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Fc1ccc(cc1)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N

STL004556
Synonyms: N-cyclohexyl-2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
Smiles: Cc1ccc(cc1S(=O)(=O)NC1CCCCC1)c1nnc2n1nc(C)c1c2cccc1

STL004558
Synonyms: 5-(3-methoxyphenyl)-4-{[(E)-(2,4,6-trimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/c1c(OC)cc(cc1OC)OC)S

STL004561
Synonyms: 6-(3,4-dimethoxyphenyl)-7-(2-fluorophenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nc2n(n1)C(C1=C(N2)c2ccccc2OC1c1ccc(c(c1)OC)OC)c1ccccc1F

STL004562
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(2-methylphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Clc1cccc(c1)c1nnc(n1/N=C/c1ccccc1C)S

STL004563
Synonyms: (5Z)-5-(4-bromobenzylidene)-2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1,3-thiazol-4(5H)-one
Smiles: Brc1ccc(cc1)/C=C/1\SC(=NC1=O)Nc1c(C)n(n(c1=O)c1ccccc1)C

STL004564
Synonyms: 2-[(E)-{[3-(3-ethoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]-6-(prop-2-en-1-yl)phenol
Smiles: CCOc1cccc(c1)c1nnc(n1/N=C/c1cccc(c1O)CC=C)S

STL004565
Synonyms: 6-[(E)-{[(5-amino-1-phenyl-1H-pyrazol-4-yl)carbonyl]imino}methyl]-2,3-dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)/C=N/C(=O)c1cnn(c1N)c1ccccc1

STL004566
Synonyms: 3-methyl-7-(naphthalen-1-ylmethyl)-8-[(2-phenylethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2Cc1cccc2c1cccc2)NCCc1ccccc1

STL004567
Synonyms: (4Z)-4-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1c(C)nn(c1Cl)c1ccccc1)c1ccc(c(c1)[N+](=O)[O-])Cl

STL004568
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(biphenyl-4-yl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/c1ccc(cc1)c1ccccc1

STL004570
Synonyms: 2-(3,4-dichlorophenyl)cyclohexa-2,5-diene-1,4-dione
Smiles: O=C1C=CC(=O)C(=C1)c1ccc(c(c1)Cl)Cl

STL004571
Synonyms: 2-{4-[(1E)-1-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiophen-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]phenoxy}acetamide
Smiles: NC(=O)COc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1c1cccs1)c1nonc1N)/C

STL004572
Synonyms: (2Z)-2-(1,3-benzothiazol-2-yl)-3-(3-bromo-5-hydroxy-4-methoxyphenyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1cc(O)c(c(c1)Br)OC)/c1nc2c(s1)cccc2

STL004573
Synonyms: 4-({(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}amino)-5-(2-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(ccc1OCc1ccccc1)/C=N/n1c(S)nnc1c1ccccc1Cl

STL004574
Synonyms: ethyl5-(3-chloro-2-methylphenyl)-1-(4-chlorophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1C)Cl)c1ccc(cc1)Cl

STL004576
Synonyms: methyl4-ethyl-3'-(4-methoxyphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Smiles: COc1ccc(cc1)N1N=C(SC21c1ccccc1C(=NN2c1ccccc1)CC)C(=O)OC

STL004577
Synonyms: 5-{[6-hydroxy-3-(4-methylphenyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl][4-methoxy-3-(pyrrolidinium-1-ylmethyl)phenyl]methyl}-3-(4-methylphenyl)-6-oxo-2-thioxo-1,2,3,6-tetrahydropyrimidin-4-o
Smiles: COc1ccc(cc1C[NH+]1CCCC1)C(c1c(O)[nH]c(=S)n(c1=O)c1ccc(cc1)C)c1c(=O)[nH]c(=S)n(c1[O-])c1ccc(cc1)C

STL004578
Synonyms: 4-[(4-ethoxyphenyl)carbonyl]-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-hydroxy-5-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1)c1sc2c(n1)ccc(c2)CC

STL004579
Synonyms: 1,3-dimethyl-8-[(2-methylprop-2-en-1-yl)sulfanyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=C)CSc1nc2c(n1CCCc1ccccc1)c(=O)n(c(=O)n2C)C

STL004580
Synonyms: 3-(3-ethoxypropyl)-5-(4-fluorophenyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl4-fluorobenzoate
Smiles: CCOCCCn1cc(c2c1nc(c1ccc(cc1)F)n1c2nc2c1cccc2)OC(=O)c1ccc(cc1)F

STL004581
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-N'-{(E)-[3-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1cccc(c1)C(F)(F)F

STL004582
Synonyms: N-cyclohexyl-2-methoxy-N-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)N(C1CCCCC1)C)c1nnc2n1nc(C)c1c2cccc1

STL004583
Synonyms: methyl4-{(E)-[2-({[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)CSc1nc2ccccc2c(=O)n1c1ccccc1C

STL004584
Synonyms: {2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenoxy}aceticacid
Smiles: COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1OCC(=O)O

STL004585
Synonyms: 7-(1,3-benzodioxol-5-yl)-8-(4-ethoxyphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCOc1ccc(cc1)n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc2c(c1)OCO2

STL004587
Synonyms: 7-(2,4-dichlorobenzyl)-1,3-dimethyl-8-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(c(c1)Cl)Cn1c(N/N=C/c2cccnc2)nc2c1c(=O)n(c(=O)n2C)C

STL004588
Synonyms: 2-methoxy-6-phenyl-3-[5-(pyridin-4-yl)-1,2,4-oxadiazol-3-yl]pyridine
Smiles: COc1nc(ccc1c1noc(n1)c1ccncc1)c1ccccc1

STL004589
Synonyms: methyl4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoate
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)C(=O)OC

STL004590
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2CSc2ccccc2)c2nonc2N)cccc1OC

STL004591
Synonyms: N-(2,4-dimethylphenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)Nc2ccc(cc2C)C)c2c(n1)c1ccccc1o2

STL004592
Synonyms: diethyl[(2,2-diethoxy-1-methyl-2-oxido-2lambda~5~-diazan-1-yl)methyl]phosphonate
Smiles: CCOP(=O)(CN(N(=O)(OCC)OCC)C)OCC

STL004593
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-1-[(4-ethylphenyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)CC)C)NC(=O)OC(C)(C)C

STL004594
Synonyms: 1-[5-(2,4-dichlorobenzyl)-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea
Smiles: CCOc1ccc(cc1)NC(=O)Nc1nnc(s1)Cc1ccc(cc1Cl)Cl

STL004595
Synonyms: dipropan-2-yl[(phenylamino)(3,4,5-trimethoxyphenyl)methyl]phosphonate
Smiles: COc1cc(cc(c1OC)OC)C(P(=O)(OC(C)C)OC(C)C)Nc1ccccc1

STL004596
Synonyms: 3-({[(2Z)-2-{[4-(ethoxycarbonyl)phenyl]imino}-3-ethyl-4-oxo-1,3-thiazinan-6-yl]carbonyl}amino)benzoicacid
Smiles: CCOC(=O)c1ccc(cc1)/N=C/1\SC(CC(=O)N1CC)C(=O)Nc1cccc(c1)C(=O)O

STL004597
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dichlorophenyl)-N'-[(1E)-1-(3,4-dimethoxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(ccc1OC)/C(=N/NC(=O)c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)/C

STL004598
Synonyms: 6-(3-hydroxy-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-dimethyl-5-(3-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Cc1cccc(c1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1cc2CCCCc2cc1O

STL004599
Synonyms: tert-butyl4-(2-chlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: S=C1NC(=C(C(N1)c1ccccc1Cl)C(=O)OC(C)(C)C)C

STL004600
Synonyms: 3-(4-chlorobenzyl)-1-methyl-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Clc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccccc1

STL004601
Synonyms: 2-[3,5-bis(4-amino-1,2,5-oxadiazol-3-yl)-1H-1,2,4-triazol-1-yl]-N'-[(E)-(4-methylphenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nc(nc1c1nonc1N)c1nonc1N)N/N=C/c1ccc(cc1)C

STL004602
Synonyms: 1-(3-chlorobenzyl)-3,7-dimethyl-8-{[3-(propan-2-yloxy)propyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(OCCCNc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1cccc(c1)Cl)C

STL004603
Synonyms: 4-({(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}amino)-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(ccc1OCc1ccccc1)/C=N/n1c(S)nnc1c1cccc(c1)C

STL004604
Synonyms: 6-(4-ethylpiperazin-1-yl)-1,4-dimethyl-5-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: CCN1CCN(CC1)c1c(/C=C/2\SC(=S)N(C2=O)CC(C)C)c(C)c(c(=O)n1C)C#N

STL004605
Synonyms: 7-[(2E)-but-2-en-1-yl]-3-methyl-8-(pentylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCSc1nc2c(n1C/C=C/C)c(=O)[nH]c(=O)n2C

STL004606
Synonyms: N-(4-nitrophenyl)thieno[3,2-b][1]benzothiophene-2-carboxamide
Smiles: O=C(c1cc2c(s1)c1c(s2)cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STL004607
Synonyms: 1-[(E)-{[4-(naphthalen-1-ylmethyl)piperazin-1-yl]imino}methyl]naphthalen-2-ol
Smiles: Oc1ccc2c(c1/C=N/N1CCN(CC1)Cc1cccc3c1cccc3)cccc2

STL004608
Synonyms: 10-acetyl-3-(4-chlorophenyl)-11-(4-fluorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Fc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)Cl)Nc2c(N1C(=O)C)cccc2

STL004609
Synonyms: 2-[(E)-{[3-(3-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]-6-methoxyphenol
Smiles: COc1cccc(c1O)/C=N/n1c(S)nnc1c1cccc(c1)Cl

STL004612
Synonyms: 5-(2-chlorophenyl)-4-({(E)-[2-(trifluoromethyl)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccccc1c1nnc(n1/N=C/c1ccccc1C(F)(F)F)S

STL004613
Synonyms: ethyl5-(3-chloro-2-methylphenyl)-1-(2-chlorophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1C)Cl)c1ccccc1Cl

STL004614
Synonyms: N-(4-chlorophenyl)-2-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nc(C)nc2c1oc1c2cccc1

STL004615
Synonyms: 9-(4-ethylphenyl)-1-methyl-3-(2-methylprop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CC(=C)C

STL004616
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(1E)-1-(4-hydroxyphenyl)propylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)O)\CC

STL004617
Synonyms: methyl5-(3-chloro-2-methylphenyl)-1-(3-chlorophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1C)Cl)c1cccc(c1)Cl

STL004618
Synonyms: 1,7-dimethyl-9-(3-methylphenyl)-3-(3-phenylpropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1cccc(c1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CCCc1ccccc1

STL004619
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-thiophen-2-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccs1

STL004620
Synonyms: 1-methyl-9-(3-methylphenyl)-3-pentyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)C

STL004621
Synonyms: (4-chlorophenyl)[1-hydroxy-2,5-dimethyl-3-oxido-4-(thiophen-2-yl)-2,5-dihydro-1H-imidazol-2-yl]methanone
Smiles: Clc1ccc(cc1)C(=O)C1(C)N(O)C(C(=[N+]1[O-])c1cccs1)C

STL004622
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-furan-2-ylmethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1ccco1

STL004623
Synonyms: 4-bromophenyl8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate
Smiles: Cc1ccc(cc1)c1cc(C(=O)Oc2ccc(cc2)Br)c2c(n1)c(C)ccc2

STL004625
Synonyms: 7-(4-bromobenzyl)-1,3-dimethyl-8-{[3-(morpholin-4-yl)propyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)Cn1c(NCCCN2CCOCC2)nc2c1c(=O)n(c(=O)n2C)C

STL004626
Synonyms: 4-(5-chloro-4-{4,5-dibromo-2-[4-(morpholin-4-yl)butoxy]phenoxy}-3,6-difluoropyridin-2-yl)morpholine
Smiles: Brc1cc(OCCCCN2CCOCC2)c(cc1Br)Oc1c(F)c(nc(c1Cl)F)N1CCOCC1

STL004628
Synonyms: 5-(2-methoxyphenyl)-2-phenyl-3-(2,4,5-trimethoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: COc1cc(OC)c(cc1C1N(OC2C1C(=O)N(C2=O)c1ccccc1OC)c1ccccc1)OC

STL004629
Synonyms: 8-[(2E)-2-(2-hydroxy-3-methoxybenzylidene)hydrazinyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cccc(c1O)/C=N/Nc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STL004630
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(5-methylthiophen-2-yl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(s1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N

STL004631
Synonyms: (5Z)-5-[4-(azepan-1-yl)benzylidene]-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=S)NC(=O)/C(=C/c2ccc(cc2)N2CCCCCC2)/C1=O

STL004632
Synonyms: N-(2,5-dimethoxyphenyl)-6-nitro-2-oxo-2H-chromene-3-carboxamide
Smiles: COc1ccc(c(c1)NC(=O)c1cc2cc(ccc2oc1=O)[N+](=O)[O-])OC

STL004633
Synonyms: 2-[(butylsulfanyl)methyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCCSCc1nc2c3ccccc3CC3(c2c(=O)[nH]1)CCCC3

STL004634
Synonyms: N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-N-(4-methoxyphenyl)-3-methylbutanamide
Smiles: COc1ccc(cc1)N(C(=O)CC(C)C)Cc1cc2cccc(c2nc1O)C

STL004635
Synonyms: 7-[2-hydroxy-3-(2-methylphenoxy)propyl]-8-[(3-methoxypropyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCCNc1nc2c(n1CC(COc1ccccc1C)O)c(=O)[nH]c(=O)n2C

STL004637
Synonyms: N-[1-(4-chlorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]thiophene-2-carboxamide
Smiles: Clc1ccc(cc1)n1c(=O)[nH]c(=O)c2c1NC(=O)C2(NC(=O)c1cccs1)C(F)(F)F

STL004638
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-naphthalen-1-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc2c1cccc2)C

STL004639
Synonyms: 7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-(pyrrolidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCC1)COc1ccccc1

STL004640
Synonyms: N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-3-methoxy-N-phenylbenzamide
Smiles: COc1cccc(c1)C(=O)N(c1ccccc1)Cc1cc2cccc(c2nc1O)C

STL004641
Synonyms: N-({4-hydroxy-3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}carbamothioyl)furan-2-carboxamide
Smiles: S=C(NC(=O)c1ccco1)Nc1ccc(c(c1)c1nc2c(o1)ccc(c2)C(C)C)O

STL004642
Synonyms: 2-ethyl-5-{2-[(3-nitrophenyl)carbonyl]hydrazinyl}-5-oxopentanoicacid
Smiles: CCC(C(=O)O)CCC(=O)NNC(=O)c1cccc(c1)[N+](=O)[O-]

STL004643
Synonyms: 2-{[4-amino-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)acetamide
Smiles: COc1cc(ccc1OC)c1nnc(n1N)SCC(=O)Nc1ccc(c(c1)F)C

STL004645
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-ethoxyphenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N

STL004646
Synonyms: N-(4-butylphenyl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: CCCCc1ccc(cc1)NC(=O)C12CCC(C2(C)C)(C(=O)O1)C

STL004647
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(3-methylthiophen-2-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1sccc1C

STL004648
Synonyms: N'-[(E)-(3,4-dichlorophenyl)methylidene]-2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1)N/N=C/c1ccc(c(c1)Cl)Cl

STL004649
Synonyms: methyl5-(4-iodophenyl)-1-nitroso-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)I)N=O

STL004651
Synonyms: 1-(4-bromophenyl)-5-(4-chlorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C1N(c2ccc(cc2)Br)C(=O)C(=C1C(=O)c1ccccc1)O

STL004652
Synonyms: 9-(4-ethoxyphenyl)-3-(2-methoxyethyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(cc1)OCC

STL004653
Synonyms: 9-(3,5-dimethylphenyl)-1,7-dimethyl-3-(3-methylbutyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC(CCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cc(C)cc(c1)C)C

STL004654
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N'-[(1E)-1-(naphthalen-2-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1nncn1C)c1nonc1N)N/N=C(/c1ccc2c(c1)cccc2)\C

STL004655
Synonyms: 3-methyl-8-(3-methylpiperidin-1-yl)-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCCN(C1)c1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STL004656
Synonyms: 2-ethoxy-4-[(E)-(2-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenylacetate
Smiles: CCOc1cc(/C=N/NC(=O)CSc2nncn2C)ccc1OC(=O)C

STL004657
Synonyms: 8-(1H-benzimidazol-2-ylsulfanyl)-7-(2-chlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1Cn1c(Sc2nc3c([nH]2)cccc3)nc2c1c(=O)n(c(=O)n2C)C

STL004658
Synonyms: 3-(2-methylphenyl)-2-[(2-phenoxyethyl)sulfanyl]quinazolin-4(3H)-one
Smiles: Cc1ccccc1n1c(SCCOc2ccccc2)nc2c(c1=O)cccc2

STL004659
Synonyms: 2-chloro-6-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1OC)C1Oc2ccc(cc2C2=C1C(c1ccc(cc1)F)n1c(N2)ncn1)Cl

STL004660
Synonyms: 3,4,5-triethoxy-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-methylbenzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)N(Cc1cc2cc(C)ccc2nc1O)C

STL004661
Synonyms: N-{(2R)-1-[(3-butoxypropyl)amino]-1-oxopropan-2-yl}-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: CCCCOCCCNC(=O)[C@H](NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)C

STL004662
Synonyms: 6-hydroxy-5-[{6-hydroxy-2,4-dioxo-3-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidin-5-yl}(pyridin-4-yl)methyl]-1-[3-(trifluoromethyl)phenyl]pyrimidine-2,4(1H,3H)-dione
Smiles: O=c1[nH]c(=O)c(c(n1c1cccc(c1)C(F)(F)F)O)C(c1c(O)[nH]c(=O)n(c1=O)c1cccc(c1)C(F)(F)F)c1ccncc1

STL004663
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1ccc2c(c1)OCO2

STL004664
Synonyms: 1-(2,5-dichlorothiophen-3-yl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone
Smiles: CCc1nc(SCC(=O)c2cc(sc2Cl)Cl)c2c(n1)c1ccccc1o2

STL004665
Synonyms: 9-(3,5-dimethylphenyl)-1,7-dimethyl-3-(4-methylbenzyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1ccc(cc1)Cn1c(=O)c2n3CC(C)CN(c3nc2n(c1=O)C)c1cc(C)cc(c1)C

STL004666
Synonyms: N-(2,5-dimethylphenyl)-N-[(2-hydroxyquinolin-3-yl)methyl]-4-nitrobenzamide
Smiles: Cc1ccc(c(c1)N(C(=O)c1ccc(cc1)[N+](=O)[O-])Cc1cc2ccccc2nc1O)C

STL004667
Synonyms: N-(2,3-dimethylphenyl)-N-[(2-hydroxyquinolin-3-yl)methyl]-3-methoxybenzamide
Smiles: COc1cccc(c1)C(=O)N(c1cccc(c1C)C)Cc1cc2ccccc2nc1O