FULL DB

Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )

STL004668
Synonyms: N,N-dimethyltetrahydrothiophen-3-aminium1,1-dioxide
Smiles: C[NH+](C1CCS(=O)(=O)C1)C

STL004669
Synonyms: 1-(4-chlorophenyl)-3-[(4-chlorophenyl)(hydroxy)amino]pyrrolidine-2,5-dione
Smiles: Clc1ccc(cc1)N(C1CC(=O)N(C1=O)c1ccc(cc1)Cl)O

STL004670
Synonyms: 5,6-dimethyl-2,3-bis(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Cc1ccc(cc1)n1c(nc2c(c1=O)c(C)c(s2)C)c1ccc(cc1)C

STL004671
Synonyms: 2-[(4-chlorophenyl)sulfanyl]-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]acetamide
Smiles: COc1cc(ccc1OC)c1nnc(s1)NC(=O)CSc1ccc(cc1)Cl

STL004672
Synonyms: N-[({[(3E,8xi,9xi,14xi)-17-hydroxyandrost-4-en-3-ylidene]amino}oxy)acetyl]isoleucine
Smiles: CCC(C(C(=O)O)NC(=O)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2O)C)C)C

STL004673
Synonyms: N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]-N-(2-methoxyphenyl)butanamide
Smiles: CCCC(=O)N(c1ccccc1OC)Cc1cc2cccc(c2nc1O)C

STL004674
Synonyms: (12bS)-7-(2-chlorophenyl)-2-[2-(cyclohex-1-en-1-yl)ethyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCC1=CCCCC1

STL004675
Synonyms: 2-{[3-cyano-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)pyridin-2-yl]sulfanyl}-N-(2,6-difluorophenyl)acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1c(F)cccc1F)C12CC3CC(C2)CC(C1)C3

STL004676
Synonyms: 4-chloro-2-[4-(3-nitrophenyl)-6-phenylpyridin-2-yl]phenol
Smiles: Clc1ccc(c(c1)c1cc(cc(n1)c1ccccc1)c1cccc(c1)[N+](=O)[O-])O

STL004677
Synonyms: (5Z)-5-{[5-(3,4-dichlorophenyl)furan-2-yl]methylidene}-2-(4-methylpiperazin-1-yl)-1,3-thiazol-4(5H)-one
Smiles: CN1CCN(CC1)C1=NC(=O)/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)Cl)/S1

STL004678
Synonyms: 6-(4-benzylpiperazin-1-yl)-5-[(Z)-(3-cyclopentyl-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)C2CCCC2)c(n(c1=O)C)N1CCN(CC1)Cc1ccccc1

STL004679
Synonyms: 3-(4-methylphenyl)-4,5-diphenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Smiles: Cc1ccc(cc1)c1n[nH]c2c1C(c1ccccc1)N(C2=O)c1ccccc1

STL004681
Synonyms: 1-(4-chlorophenyl)-4-(3,4-dichlorophenyl)-N-propyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCCNC(=O)c1c(c2ccc(cc2)Cl)c2c3n1cc(n3CCCC2)c1ccc(c(c1)Cl)Cl

STL004682
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(c(c1OC)OC)OC

STL004683
Synonyms: 1,3-dimethyl-7-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1nnc(s1)SCCn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCOCC1

STL004684
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-(2-methylphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccccc2C)nc2c(c1=O)cccc2

STL004685
Synonyms: 3-(2,4-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(cc1Cl)Cl

STL004687
Synonyms: ethyl4-({[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nc(N)c2c(n1)sc1c2CCCC1

STL004688
Synonyms: (5Z)-5-(4-ethylbenzylidene)-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-4(5H)-one
Smiles: CCc1ccc(cc1)/C=C/1\SC(=NC1=O)N1CCN(CC1)c1ccccc1

STL004689
Synonyms: 4-[(4-chlorophenyl)carbonyl]-5-[4-(dimethylamino)phenyl]-3-hydroxy-1-(tetrahydrofuran-2-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)N(C)C)CC1CCCO1

STL004690
Synonyms: 7-(4-chlorophenyl)-8-(2,4-dimethylphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(cc1)c1cn2c(n1c1ccc(cc1C)C)nc1c2c(=O)n(C)c(=O)n1C

STL004691
Synonyms: 3-(2-chloro-6-fluorobenzyl)-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)Cc1c(F)cccc1Cl

STL004692
Synonyms: 10a-[(E)-2-(2,6-dichlorophenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: O=C1CCN2C(N1)(/C=C/c1c(Cl)cccc1Cl)C(C)(C)c1c2cccc1

STL004694
Synonyms: N-(2,5-dimethylphenyl)-N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]butanamide
Smiles: CCCC(=O)N(c1cc(C)ccc1C)Cc1cc2ccc(cc2nc1O)C

STL004695
Synonyms: N'-[(1E)-1-(4-bromophenyl)ethylidene]-2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1)N/N=C(/c1ccc(cc1)Br)\C

STL004696
Synonyms: 10a-[(E)-2-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: COc1cc(ccc1OCc1ccc(cc1)C)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1

STL004697
Synonyms: 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(1E)-1-(naphthalen-1-yl)ethylidene]acetohydrazide
Smiles: O=C(CSc1nncn1C)N/N=C(/c1cccc2c1cccc2)\C

STL004698
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1c(C)nn(c1Cl)c1ccccc1)C

STL004699
Synonyms: 9-(4-ethoxyphenyl)-1,7-dimethyl-3-(4-methylbenzyl)-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)C

STL004700
Synonyms: 2-(2,2-dicyanoethenyl)-1H-indol-3-ylacetate
Smiles: N#CC(=Cc1[nH]c2c(c1OC(=O)C)cccc2)C#N

STL004701
Synonyms: 2-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanedioicacid
Smiles: OC(=O)CCC(N1C(=S)S/C(=C\c2ccc(cc2)F)/C1=O)C(=O)O

STL004702
Synonyms: N-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetyl}benzamide
Smiles: O=C(NC(=O)c1ccccc1)CSc1nnnn1c1ccccc1

STL004703
Synonyms: 2-chloro-N-{2-[3-(1,2-dimethyl-1H-indol-3-yl)-2,2-dimethylcyclopropyl]ethyl}acetamide
Smiles: ClCC(=O)NCCC1C(C1(C)C)c1c(C)n(c2c1cccc2)C

STL004704
Synonyms: N-(3-{(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}phenyl)acetamide
Smiles: CC(=O)Nc1cccc(c1)/C(=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/C

STL004705
Synonyms: 7-(2-methoxyethyl)-1,3-dimethyl-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STL004706
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-ethoxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N

STL004707
Synonyms: 3-hydroxy-1-[3-(morpholin-4-yl)propyl]-5-[4-(propan-2-yloxy)phenyl]-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(Oc1ccc(cc1)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1cccs1)O)C

STL004708
Synonyms: 1-[7-(3,4-dichlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)c1nc2c(n1Cc1ccc(c(c1)Cl)Cl)c(=O)n(c(=O)n2C)C

STL004709
Synonyms: (5Z)-5-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-methoxybenzylidene}-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)/C=C\1/C(=O)NC(=O)N(C1=O)Cc1ccco1

STL004711
Synonyms: 1,7-dimethyl-9-(4-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)n1CC(C)CN(c1n2)c1ccc(cc1)C

STL004712
Synonyms: 5-(3-chlorophenyl)-4-({(E)-[4-(trifluoromethyl)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1cccc(c1)c1nnc(n1/N=C/c1ccc(cc1)C(F)(F)F)S

STL004713
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-chlorophenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1cccc(c1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N

STL004714
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-hydroxyphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)N/N=C/c1ccccc1O

STL004715
Synonyms: 3-methyl-8-[(2E)-2-(4-methylbenzylidene)hydrazinyl]-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1cccc3c1cccc3)c(=O)[nH]c(=O)n2C

STL004716
Synonyms: 3-(1H-benzotriazol-1-yl)-N'-[(1E)-1-(pyridin-4-yl)ethylidene]propanehydrazide
Smiles: O=C(CCn1nnc2c1cccc2)N/N=C(/c1ccncc1)\C

STL004717
Synonyms: N-{2-[2-(4-fluorophenyl)-4-hydroxy-5-oxo-3-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]ethyl}acetamide
Smiles: CC(=O)NCCN1C(c2ccc(cc2)F)C(=C(C1=O)O)C(=O)c1ccccc1

STL004718
Synonyms: 5-(3-methoxyphenyl)-4-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/c1ccc(cc1)C(C)C)S

STL004719
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-N'-[(E)-thiophen-2-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1cccs1

STL004720
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1ccc(cc1)N(C)C

STL004721
Synonyms: 2-(5,6-dihydrobenzimidazo[1,2-c]quinazolin-6-yl)-4-nitrophenol
Smiles: Oc1ccc(cc1C1Nc2ccccc2c2n1c1ccccc1n2)[N+](=O)[O-]

STL004722
Synonyms: [1-hydroxy-2,5-dimethyl-3-oxido-4-(thiophen-2-yl)-2,5-dihydro-1H-imidazol-2-yl](4-methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)C1(C)N(O)C(C(=[N+]1[O-])c1cccs1)C

STL004723
Synonyms: N-(2-{[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]amino}-2-oxoethyl)-2-[(6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]acetamide
Smiles: O=C(COc1ccc2c(c1)oc(=O)c1c2CCCC1)NCC(=O)NCC(=O)N1CCC2(C(C1)CCCC2)O

STL004724
Synonyms: N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-3,4,5-trimethoxy-N-(3-methoxyphenyl)benzamide
Smiles: COc1cccc(c1)N(C(=O)c1cc(OC)c(c(c1)OC)OC)Cc1cc2cc(C)ccc2nc1O

STL004725
Synonyms: methyl[9-(4-ethoxyphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Smiles: CCOc1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)OC

STL004726
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(3-methoxyphenyl)ethylidene]-5-propyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1cccc(c1)OC)\C

STL004727
Synonyms: 1-(3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Smiles: CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCC(CC2)C(=O)N)/C1=O)C

STL004728
Synonyms: 1-[1,4-bis(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]ethanone
Smiles: Cc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)C)c1ccc(cc1)C

STL004729
Synonyms: {2-[(E)-{[3-(4-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccccc1/C=N/n1c(S)nnc1c1ccc(cc1)Cl

STL004730
Synonyms: 1-[3-(dimethylamino)propyl]-3-hydroxy-4-[(4-propoxyphenyl)carbonyl]-5-(thiophen-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccs1)CCCN(C)C

STL004731
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-chlorophenyl)methylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)Cl

STL004732
Synonyms: 3-methyl-7-(naphthalen-1-ylmethyl)-8-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2Cc1cccc2c1cccc2)N/N=C/c1cccnc1

STL004733
Synonyms: (12bS)-7-(2-chlorophenyl)-12b-methyl-2-(4-methylbenzyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Cc1ccc(cc1)CN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1C(C2)c1ccccc1Cl)cccc3

STL004734
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(2-ethoxyphenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccccc1/C(=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/C

STL004735
Synonyms: 7-{4-[(3-chlorophenyl)carbonyl]piperazin-1-yl}-1-cyclopropyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCc1nnc(s1)NC(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1cccc(c1)Cl)F

STL004736
Synonyms: 9-(3,5-dimethylphenyl)-3-(2-ethoxyethyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cc(C)cc(c1)C

STL004737
Synonyms: 1-methyl-9-(3-methylphenyl)-3-(2-methylprop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)C

STL004738
Synonyms: 5-benzyl-2-(3-nitrophenyl)-3-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: O=C1N(Cc2ccccc2)C(=O)C2C1ON(C2c1ccccc1)c1cccc(c1)[N+](=O)[O-]

STL004739
Synonyms: N-[6,6-dimethyl-1-(4-methylphenyl)-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-2-methylbenzamide
Smiles: Cc1ccc(cc1)N1C2=C(C(C1=O)(NC(=O)c1ccccc1C)C(F)(F)F)C(=O)CC(C2)(C)C

STL004740
Synonyms: tert-butyl{(2S)-4-methyl-1-[4-({(2S)-1-[(4-methylbenzyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-1-oxopentan-2-yl}carbamate
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)C)C)NC(=O)OC(C)(C)C)C

STL004741
Synonyms: 1-(pyridin-2-ylmethoxy)-3-(thiophen-2-yl)quinoxalin-2(1H)-one4-oxide
Smiles: [O-][n+]1c(c2cccs2)c(=O)n(c2c1cccc2)OCc1ccccn1

STL004742
Synonyms: 3-butyl-9-(4-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)OC

STL004743
Synonyms: 9-(4-ethylphenyl)-1,7-dimethyl-3-propyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCn1c(=O)c2n3CC(C)CN(c3nc2n(c1=O)C)c1ccc(cc1)CC

STL004744
Synonyms: 4-{[(E)-furan-2-ylmethylidene]amino}-5-(3-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/c1ccco1)S

STL004745
Synonyms: N'-[(1E)-1-(biphenyl-4-yl)ethylidene]-2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1)N/N=C(/c1ccc(cc1)c1ccccc1)\C

STL004746
Synonyms: 1-(4-chlorophenyl)-N-(4-methylbenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Smiles: Cc1ccc(cc1)CNc1ncnc2c1cnn2c1ccc(cc1)Cl

STL004747
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)OC

STL004748
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-methylphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N

STL004749
Synonyms: 2,6-di-tert-butyl-4-{(E)-[(5,6-dimethyl-1H-benzimidazol-1-yl)imino]methyl}phenol
Smiles: Cc1cc2ncn(c2cc1C)/N=C/c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

STL004750
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-hydroxy-3-methoxyphenyl)ethylidene]-5-propyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(c(c1)OC)O)\C

STL004751
Synonyms: N-[(2-hydroxyquinolin-3-yl)methyl]-3,4-dimethoxy-N-(2-methylphenyl)benzamide
Smiles: COc1ccc(cc1OC)C(=O)N(c1ccccc1C)Cc1cc2ccccc2nc1O

STL004752
Synonyms: 2-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2cc(OC)ccc2OC)nc2c(c1=O)c1CCCCc1s2

STL004753
Synonyms: 1-{(E)-[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}naphthalen-2-ol
Smiles: Oc1ccc2c(c1/C=N/n1c(C)nnc1C)cccc2

STL004754
Synonyms: 9-(4-ethylphenyl)-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)CC

STL004755
Synonyms: 6-methyl-3-{2-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]phenyl}[1,2,4]triazolo[3,4-a]phthalazine
Smiles: CC1CCN(CC1)S(=O)(=O)c1ccc(c(c1)c1nnc2n1nc(C)c1c2cccc1)C

STL004756
Synonyms: 4-(5-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-1H-tetrazol-1-yl)benzamide
Smiles: O=C(N1CCCCC1)CSc1nnnn1c1ccc(cc1)C(=O)N

STL004757
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dichlorophenyl)-N'-[(1E)-1-(thiophen-2-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)N/N=C(/c1cccs1)\C

STL004759
Synonyms: (9xi,14xi)-11,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl4-[(2,2-dimethoxyethyl)amino]-4-oxobutanoate
Smiles: COC(CNC(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(O)C1[C@H]2CCC2=CC(=O)C=C[C@]12C)OC

STL004761
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CSc1ccccc1)C(=O)N/N=C/c1ccccc1C(F)(F)F

STL004762
Synonyms: 5-(2,3-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-(furan-2-ylcarbonyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1c(OC)cccc1C1N(CCN(C)C)C(=O)C(=C1C(=O)c1ccco1)O

STL004763
Synonyms: 5-ethyl-6-(pyridin-3-yl)-5,6-dihydrobenzimidazo[1,2-c]quinazoline
Smiles: CCN1c2ccccc2c2n(C1c1cccnc1)c1ccccc1n2

STL004765
Synonyms: 2-methylpropyl[4-(dimethylamino)phenyl]{hydroxy[4-(propan-2-yl)phenyl]methyl}phosphinate
Smiles: CC(COP(=O)(C(c1ccc(cc1)C(C)C)O)c1ccc(cc1)N(C)C)C

STL004766
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(naphthalen-2-yl)ethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C(/c1ccc2c(c1)cccc2)\C

STL004768
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-propyl-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(OC)c(cc1OC)OC

STL004769
Synonyms: N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(2-methoxyphenyl)-3-nitrobenzamide
Smiles: COc1ccccc1N(C(=O)c1cccc(c1)[N+](=O)[O-])Cc1cc2cc(C)ccc2nc1O

STL004770
Synonyms: 2-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: Cc1ccccc1C(=O)NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2CCc1ccccc1)C(F)(F)F

STL004771
Synonyms: (8xi,9xi,14xi)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-4-oxobutanoate
Smiles: O=C(OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(O)C1C2CCC2=CC(=O)CC[C@]12C)CCC(=O)NCCC1=CCCCC1

STL004772
Synonyms: methyl(5-{[(3-bromophenyl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)acetate
Smiles: COC(=O)Cc1nnc(s1)NC(=O)c1cccc(c1)Br

STL004773
Synonyms: N,N'-(octane-1,8-diyldi-1,3,4-thiadiazole-5,2-diyl)bis(2-methylpropanamide)
Smiles: CC(C(=O)Nc1nnc(s1)CCCCCCCCc1nnc(s1)NC(=O)C(C)C)C

STL004774
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(2-fluorophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1F

STL004775
Synonyms: 9-(4-ethoxyphenyl)-3-(4-fluorobenzyl)-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)F

STL004776
Synonyms: 8-(azepan-1-yl)-7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)[nH]c(=O)c2c1nc(n2CCSc1nc2c(s1)cccc2)N1CCCCCC1

STL004777
Synonyms: (2E)-2-(1,3-benzothiazol-2-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc2OCOc2cc1[N+](=O)[O-])/c1nc2c(s1)cccc2

STL004778
Synonyms: 4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl)c1ccccn1

STL004779
Synonyms: 2-ethoxy-4-[(E)-{[3-(4-ethoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]phenol
Smiles: CCOc1ccc(cc1)c1nnc(n1/N=C/c1ccc(c(c1)OCC)O)S

STL004780
Synonyms: 6-(3-hydroxy-5,6,7,8-tetrahydronaphthalen-2-yl)-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)c1cc2CCCCc2cc1O

STL004781
Synonyms: 3-(3-methoxypropyl)-5-(thiophen-2-yl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-ylthiophene-2-carboxylate
Smiles: COCCCn1cc(c2c1nc(c1cccs1)n1c2nc2c1cccc2)OC(=O)c1cccs1

STL004782
Synonyms: 6-chloro-N-(2,4-dimethylphenyl)-2-(1H-indol-3-yl)imidazo[1,2-a]pyridin-3-amine
Smiles: Clc1ccc2n(c1)c(Nc1ccc(cc1C)C)c(n2)c1c[nH]c2c1cccc2

STL004784
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N

STL004785
Synonyms: N-(2-{4,4-dimethyl-2-[(4-methylphenyl)amino]-6-oxocyclohex-1-en-1-yl}-1,1,1,3,3,3-hexafluoropropan-2-yl)pyridine-3-carboxamide
Smiles: Cc1ccc(cc1)NC1=C(C(=O)CC(C1)(C)C)C(C(F)(F)F)(C(F)(F)F)NC(=O)c1cccnc1

STL004786
Synonyms: 2-methoxy-3-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]quinoline
Smiles: COc1nc2ccccc2cc1c1noc(n1)c1cccc(c1)OC

STL004787
Synonyms: 3-(4-fluorobenzyl)-1,7-dimethyl-9-(4-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)F

STL004788
Synonyms: 6-chloro-N-(9-ethyl-9H-carbazol-3-yl)pyridine-3-sulfonamide
Smiles: CCn1c2ccc(cc2c2c1cccc2)NS(=O)(=O)c1ccc(nc1)Cl

STL004789
Synonyms: 4-[2-(4-fluorophenyl)-4-hydroxy-5-oxo-3-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: Fc1ccc(cc1)C1C(=C(C(=O)N1c1c(=O)n(n(c1C)C)c1ccccc1)O)C(=O)c1ccccc1

STL004790
Synonyms: {2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccccc1/C=N/NC(=O)c1nnn(c1CN(C1CCCCC1)C)c1nonc1N

STL004792
Synonyms: N'-[(E)-(3,5-dibromo-2-hydroxyphenyl)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(Br)cc(c1O)Br

STL004793
Synonyms: N-(4-iodophenyl)-5,7-dinitroquinolin-8-amine
Smiles: Ic1ccc(cc1)Nc1c(cc(c2c1nccc2)[N+](=O)[O-])[N+](=O)[O-]

STL004794
Synonyms: 1,1'-{6-hydroxy-4-[(4-methoxyphenyl)amino]-6-methyl-2-phenylcyclohex-3-ene-1,3-diyl}diethanone
Smiles: COc1ccc(cc1)NC1=C(C(=O)C)C(C(C(C1)(C)O)C(=O)C)c1ccccc1

STL004795
Synonyms: 6-(8-aminonaphthalen-1-yl)-5-(4-tert-butylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Cn1c(=O)c2c(c3ccc(cc3)C(C)(C)C)n(cc2n(c1=O)C)c1cccc2c1c(N)ccc2

STL004796
Synonyms: N-(4-bromophenyl)-2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Br

STL004797
Synonyms: 7-(2-fluorophenyl)-10-(methylsulfanyl)-6-phenyl-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nn2c(n1)NC1=C(C2c2ccccc2F)C(Oc2c1cccc2)c1ccccc1

STL004798
Synonyms: (5E)-1-(3-chlorophenyl)-5-({[2-(piperidin-1-yl)ethyl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Clc1cccc(c1)N1C(=S)NC(=O)/C(=C\NCCN2CCCCC2)/C1=O

STL004799
Synonyms: 1,1-dioxidotetrahydrothiophen-3-ylmethylcarbonate
Smiles: COC(=O)OC1CCS(=O)(=O)C1

STL004800
Synonyms: {2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccccc1/C=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N

STL004801
Synonyms: 7-(4-ethoxyphenyl)-8-(2-methoxyethyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)OCC

STL004803
Synonyms: 5-(3-chlorophenyl)-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1cccc(c1)c1nnc(n1/N=C/c1ccc(cc1)N(C)C)S

STL004804
Synonyms: 2-[(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]benzoicacid
Smiles: Cc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1C(=O)O

STL004805
Synonyms: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(4-methoxybenzylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N

STL004806
Synonyms: N-{[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]carbamothioyl}-1-benzofuran-2-carboxamide
Smiles: CCCC(=O)N1CCN(CC1)c1ccc(cc1Cl)NC(=S)NC(=O)c1cc2c(o1)cccc2

STL004807
Synonyms: 3-(5-bromo-2-hydroxyphenyl)-N-(furan-2-ylmethyl)-3-phenylpropanamide
Smiles: O=C(CC(c1cc(Br)ccc1O)c1ccccc1)NCc1ccco1

STL004808
Synonyms: 5-(2-chlorophenyl)-4-({(E)-[4-(pentyloxy)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Smiles: CCCCCOc1ccc(cc1)/C=N/n1c(S)nnc1c1ccccc1Cl

STL004809
Synonyms: N'-[(E)-(1-cyclohexyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]pentanehydrazide
Smiles: CCCCC(=O)NN/C=C/1\C(=O)NC(=S)N(C1=O)C1CCCCC1

STL004810
Synonyms: 7-benzyl-3-methyl-8-(3-methylpiperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCCN(C1)c1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C

STL004811
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-ethoxyphenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/C

STL004812
Synonyms: N-[(2-hydroxy-6-methoxyquinolin-3-yl)methyl]-N-(4-methylphenyl)-2-phenoxyacetamide
Smiles: COc1ccc2c(c1)cc(c(n2)O)CN(c1ccc(cc1)C)C(=O)COc1ccccc1

STL004813
Synonyms: (4Z)-2-(1,3-benzothiazol-2-yl)-4-[(cyclopentylamino)methylidene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1N(N=C(/C/1=C/NC1CCCC1)C(F)(F)F)c1nc2c(s1)cccc2

STL004814
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-cyclohex-3-en-1-ylmethylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/C1CCC=CC1

STL004815
Synonyms: 8-(cyclohexylamino)-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n(Cc1cccc3c1cccc3)c(n2)NC1CCCCC1

STL004816
Synonyms: 3-[2-(cyclohex-1-en-1-yl)ethyl]-5-(4-methylphenyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl4-methylbenzoate
Smiles: Cc1ccc(cc1)C(=O)Oc1cn(c2c1c1nc3c(n1c(n2)c1ccc(cc1)C)cccc3)CCC1=CCCCC1

STL004817
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-N'-[(E)-thiophen-2-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1cccs1

STL004818
Synonyms: 7-(2-hydroxyethyl)-8-{(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C(/c2ccc(cc2)OC)\C)nc2c1c(=O)[nH]c(=O)n2C

STL004819
Synonyms: 2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-phenylmethylidene]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1C)N/N=C/c1ccccc1

STL004820
Synonyms: 2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1C)N/N=C/c1ccc(cc1)C(F)(F)F

STL004821
Synonyms: 1-butyl-N-(2,5-dimethoxybenzyl)-1H-benzimidazol-2-amine
Smiles: CCCCn1c(NCc2cc(OC)ccc2OC)nc2c1cccc2

STL004822
Synonyms: N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}furan-2-carbohydrazide
Smiles: O=C(c1ccco1)N/N=C/c1ccc(cc1)C(F)(F)F

STL004823
Synonyms: ethyl2-(4-bromophenyl)-4-hydroxy-1-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)Br)c1ccc(cc1)C

STL004824
Synonyms: 9-(3,5-dimethylphenyl)-1,7-dimethyl-3-(2-methylbenzyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(c2cc(C)cc(c2)C)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)Cc1ccccc1C

STL004825
Synonyms: 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-{[({[(3E,8xi,9xi,14xi,17xi)-20-oxopregn-4-en-3-ylidene]amino}oxy)acetyl]amino}propanoicacid
Smiles: O=C(NC(C1CCOC(C1)(C)C)CC(=O)O)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2C(=O)C)C)C

STL004826
Synonyms: 3-(4-chlorobenzyl)-1,7-dimethyl-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(c2ccccc2)c2n(C1)c1c(=O)n(Cc3ccc(cc3)Cl)c(=O)n(c1n2)C

STL004827
Synonyms: 2,3-dideoxy-1-hydrazinyl-2-(3-hydrazinyl-3-oxopropyl)-5-O-propan-2-ylpentose
Smiles: NNC(=O)C(CC(COC(C)C)O)CCC(=O)NN

STL004828
Synonyms: methyl2-{3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-5-(4-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1sc(c(n1)C)C(=O)OC

STL004829
Synonyms: (5Z)-5-(2-butoxybenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1,3-thiazol-4(5H)-one
Smiles: CCCCOc1ccccc1/C=C/1\SC(=NC1=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STL004830
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-methoxyphenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1N

STL004831
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(1E)-1-(pyridin-4-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)N/N=C(/c1ccncc1)\C

STL004832
Synonyms: N-[(2-hydroxyquinolin-3-yl)methyl]-3,4,5-trimethoxy-N-phenylbenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)N(c1ccccc1)Cc1cc2ccccc2nc1O

STL004834
Synonyms: ethyl3-amino-4-(4-chlorophenyl)-2-[(4-chlorophenyl)carbamoyl]-6-methylthieno[2,3-b]pyridine-5-carboxylate
Smiles: CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)Cl)c(N)c(s2)C(=O)Nc1ccc(cc1)Cl

STL004835
Synonyms: ethyl5-acetyl-2-({(Z)-2-cyano-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc(c(c2)OC)OC)/C#N)sc(c1C)C(=O)C

STL004836
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-(2-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccccc1c1nnc(n1/N=C/c1ccc(cc1)c1ccccc1)S

STL004837
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-furan-3-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cocc1

STL004838
Synonyms: 3-(2-chlorobenzyl)-1,7-dimethyl-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(c2ccccc2)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)Cc1ccccc1Cl

STL004839
Synonyms: (2E)-2-(1,3-benzothiazol-2-yl)-3-[2-(2,4-dichlorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1c(Oc2ccc(cc2Cl)Cl)nc2n(c1=O)cccc2)/c1nc2c(s1)cccc2

STL004840
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-phenylmethylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Clc1cccc(c1)c1nnc(n1/N=C/c1ccccc1)S

STL004841
Synonyms: 2-(4-fluorophenyl)-5,6-diphenyl-1-propyl-1H-imidazo[1,2-a]imidazole
Smiles: CCCn1c(cn2c1nc(c2c1ccccc1)c1ccccc1)c1ccc(cc1)F

STL004842
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(2-ethoxyphenyl)ethylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccccc1/C(=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N)/C

STL004843
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=C\c1ccccc1)/C=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N

STL004844
Synonyms: 8-[(dibenzylamino)methyl]-1,3-dimethyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(CN(Cc2ccccc2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STL004845
Synonyms: (3E)-3-[2-(4-bromophenyl)-2-oxoethylidene]-3,4-dihydroquinoxalin-2(1H)-one
Smiles: Brc1ccc(cc1)C(=O)/C=c\1/[nH]c2ccccc2[nH]c1=O

STL004846
Synonyms: [5-(2,5-dichlorophenyl)furan-2-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanethione
Smiles: Clc1ccc(c(c1)c1ccc(o1)C(=S)N1CCN(CC1)c1cccc(c1)C(F)(F)F)Cl

STL004847
Synonyms: 4-{[(E)-(5-bromothiophen-2-yl)methylidene]amino}-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Brc1ccc(s1)/C=N/n1c(S)nnc1c1ccccn1

STL004848
Synonyms: 7-(2-chlorobenzyl)-8-{(2E)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C(=N\Nc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C)/c1ccco1

STL004849
Synonyms: 3-amino-N-(2,3-dichlorophenyl)-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(c1Cl)Cl

STL004850
Synonyms: 10a-{(E)-2-[4-(benzyloxy)-3-ethoxyphenyl]ethenyl}-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: CCOc1cc(ccc1OCc1ccccc1)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1

STL004851
Synonyms: 6-methyl-3-phenyl[1,2,4]triazolo[3,4-a]phthalazine
Smiles: Cc1nn2c(nnc2c2c1cccc2)c1ccccc1

STL004852
Synonyms: 1-[3-(dimethylamino)propyl]-4-[(4-ethoxyphenyl)carbonyl]-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)CCCN(C)C

STL004854
Synonyms: 1-(3-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-9H-beta-carboline-3-carboxamide
Smiles: COc1ccc(cc1OC)CCNC(=O)c1nc(c2cccc(c2)Br)c2c(c1)c1ccccc1[nH]2

STL004855
Synonyms: (5E)-1-methyl-3-phenyl-5-[(piperidin-1-ylamino)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1N(C)C(=O)/C(=C\NN2CCCCC2)/C(=O)N1c1ccccc1

STL004856
Synonyms: 9-(3,5-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)c1cc(C)cc(c1)C

STL004857
Synonyms: 7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-8-(heptylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCSc1nc2c(n1CC(COc1ccc(cc1)CC)O)c(=O)[nH]c(=O)n2C

STL004858
Synonyms: 4-{[(E)-anthracen-9-ylmethylidene]amino}-5-(4-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(cc1)c1nnc(n1/N=C/c1c2ccccc2cc2c1cccc2)S

STL004859
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(5-chloro-2-hydroxyphenyl)methylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(Cl)ccc1O

STL004860
Synonyms: 7-[(2-chloro-6-fluorobenzyl)oxy]-3-(4-methyl-1,3-thiazol-2-yl)-2H-chromen-2-one
Smiles: Cc1csc(n1)c1cc2ccc(cc2oc1=O)OCc1c(F)cccc1Cl

STL004861
Synonyms: 8-(azepan-1-yl)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCCC1)COc1ccccc1

STL004862
Synonyms: 4-[(4-methylbenzyl)sulfanyl][1]benzofuro[3,2-d]pyrimidine
Smiles: Cc1ccc(cc1)CSc1ncnc2c1oc1c2cccc1

STL004863
Synonyms: [3-amino-6-(4-methoxyphenyl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl](1,3-benzodioxol-5-yl)methanone
Smiles: COc1ccc(cc1)c1nc2sc(c(c2c(c1)C(F)(F)F)N)C(=O)c1ccc2c(c1)OCO2

STL004864
Synonyms: ethyl2-[({[5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCn1c(SCC(=O)Nc2nc(c(s2)C(=O)OCC)C)nnc1CSc1nc(C)cc(n1)C

STL004865
Synonyms: 1-(4-fluorophenyl)-5-{[3-(4-fluorophenyl)-6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl][4-methoxy-3-(pyrrolidinium-1-ylmethyl)phenyl]methyl}-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccc(cc1C[NH+]1CCCC1)C(c1c(O)[nH]c(=O)n(c1=O)c1ccc(cc1)F)c1c([O-])[nH]c(=O)n(c1=O)c1ccc(cc1)F

STL004866
Synonyms: (5Z)-1-(2,3-dimethylphenyl)-5-{[(pyridin-3-ylmethyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\NCc1cccnc1)c1cccc(c1C)C

STL004867
Synonyms: N-(4-fluorophenyl)-2-oxo-2-{(2E)-2-[1-(pyridin-4-yl)ethylidene]hydrazinyl}acetamide
Smiles: Fc1ccc(cc1)NC(=O)C(=O)N/N=C(/c1ccncc1)\C

STL004868
Synonyms: N-(2-{2-[(Z)-(1-cyclopropyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1H-indol-3-yl}ethyl)propanamide
Smiles: CCC(=O)NCCc1c(/C=C\2/C(=O)NC(=S)N(C2=O)C2CC2)[nH]c2c1cccc2

STL004869
Synonyms: methyl4-[({[4-amino-5-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOc1ccc(cc1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)C(=O)OC

STL004870
Synonyms: ethyl3-amino-4-[4-(methoxycarbonyl)phenyl]-6-methyl-2-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate
Smiles: CCOC(=O)C1=C(C)Nc2c(C1c1ccc(cc1)C(=O)OC)c(N)c(s2)C(=O)C12CC3CC(C2)CC(C1)C3

STL004872
Synonyms: (5E)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-1-[4-(propan-2-yl)phenyl]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CC(c1ccc(cc1)N1C(=S)NC(=O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C1=O)C

STL004873
Synonyms: 5-[3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-(2,5-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: COc1ccc(cc1C1CC(=NN1C(=O)CCCC(=O)O)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl)OC

STL004874
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-{(E)-[3-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)C(F)(F)F

STL004875
Synonyms: 3-[4-(benzyloxy)-3-ethoxyphenyl]-5-(2-ethoxyphenyl)-2-methyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1N(C)OC2C1C(=O)N(C2=O)c1ccccc1OCC

STL004876
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-pyridin-4-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccncc1

STL004877
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-[(E)-(2,4,6-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(OC)cc(c1/C=N/NC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1N)OC

STL004878
Synonyms: N-{4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1N

STL004879
Synonyms: 1,3-diphenyl-5-({[2-(piperazin-1-yl)ethyl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: O=C1/C(=C/NCCN2CCNCC2)/C(=O)N(C(=S)N1c1ccccc1)c1ccccc1

STL004881
Synonyms: 2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Smiles: CCc1nc(SCC(=O)Nc2cccc(c2)C)c2c(n1)c1ccccc1o2

STL004882
Synonyms: (5Z)-5-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}-2-[4-(3-chlorophenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C/c2ccc(o2)c2ccc(cc2Cl)[N+](=O)[O-])/S1

STL004883
Synonyms: 2-(3-methoxyphenyl)-1-(3-methylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole
Smiles: COc1cccc(c1)c1cn2c(n1c1cccc(c1)C)nc(c2c1ccccc1)c1ccccc1

STL004884
Synonyms: 2,4-dibromo-6-[(E)-{[3-(2-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]phenol
Smiles: Brc1cc(/C=N/n2c(S)nnc2c2ccccc2Cl)c(c(c1)Br)O

STL004885
Synonyms: N-(4-ethoxyphenyl)-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-3,4-dimethoxybenzamide
Smiles: CCOc1ccc(cc1)N(C(=O)c1ccc(c(c1)OC)OC)Cc1cc2cc(C)ccc2nc1O

STL004886
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-phenylmethylidene]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1ccccc1

STL004887
Synonyms: N-[3-(imidazo[1,2-a]pyridin-2-yl)phenyl]-3,4,5-trimethoxybenzamide
Smiles: COc1c(OC)cc(cc1OC)C(=O)Nc1cccc(c1)c1nc2n(c1)cccc2

STL004890
Synonyms: 9-(4-ethylphenyl)-1,7-dimethyl-3-(2-phenylethyl)-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)CCc1ccccc1

STL004891
Synonyms: 3-hexyl-9-(3-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)OC

STL004892
Synonyms: N-(2-methoxyphenyl)-2-oxo-2-{(2E)-2-[1-(pyridin-4-yl)ethylidene]hydrazinyl}acetamide
Smiles: COc1ccccc1NC(=O)C(=O)N/N=C(/c1ccncc1)\C

STL004893
Synonyms: 3-(2-ethoxyethyl)-1-methyl-9-(4-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)C

STL004894
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-chlorophenyl)-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2c2ccccc2Cl)c2nonc2N)ccc(c1OC)OC

STL004895
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(4-ethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)OCC)c1nonc1N

STL004896
Synonyms: 1-(4-chlorophenyl)-5-{[3-(4-chlorophenyl)-6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl][4-methoxy-3-(pyrrolidinium-1-ylmethyl)phenyl]methyl}-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccc(cc1C[NH+]1CCCC1)C(c1c(O)[nH]c(=O)n(c1=O)c1ccc(cc1)Cl)c1c([O-])[nH]c(=O)n(c1=O)c1ccc(cc1)Cl

STL004897
Synonyms: 1-(5-bromopyridin-2-yl)-4-[(4-ethoxyphenyl)carbonyl]-3-hydroxy-5-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1)c1ccc(cn1)Br

STL004898
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(3E)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C\2/C(=O)Nc3c2cccc3)nc2c(c1=O)cccc2

STL004899
Synonyms: N-(4-chlorophenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)Nc2ccc(cc2)Cl)c2c(n1)c1ccccc1o2

STL004900
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-bromophenyl)ethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Brc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)/C

STL004901
Synonyms: N,N'-benzene-1,3-diylbis[2-(2,4-dioxo-1,3-thiazolidin-5-yl)acetamide]
Smiles: O=C(Nc1cccc(c1)NC(=O)CC1SC(=O)NC1=O)CC1SC(=O)NC1=O

STL004902
Synonyms: 2-(2-chlorophenoxy)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]acetamide
Smiles: COc1ccc(cc1)c1nnc(s1)NC(=O)COc1ccccc1Cl

STL004903
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(1E)-1-(3-hydroxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Oc1cccc(c1)/C(=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)/C

STL004904
Synonyms: 3-(2,4-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(cc1Cl)Cl

STL004905
Synonyms: ethyl4-[({(2E)-2-[(4-ethoxyphenyl)imino]-4-oxo-1,3-thiazolidin-5-yl}acetyl)amino]benzoate
Smiles: CCOc1ccc(cc1)/N=C/1\NC(=O)C(S1)CC(=O)Nc1ccc(cc1)C(=O)OCC

STL004906
Synonyms: 3-methyl-7-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}-8-(pyrrolidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCCSc1nnnn1c1ccccc1)c(n2)N1CCCC1)C

STL004907
Synonyms: 1,4-dimethyl-5-{(Z)-[3-(3-methylbutyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-6-(morpholin-4-yl)-2-oxo-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)N1CCOCC1

STL004909
Synonyms: 9-(3,4-dimethylphenyl)-1,7-dimethyl-3-(2-methylprop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(c(c1)C)C

STL004910
Synonyms: 1-methyl-3-(naphthalen-1-ylmethyl)-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: O=c1n(Cc2cccc3c2cccc3)c(=O)c2c(n1C)nc1n2CCCN1c1ccccc1

STL004911
Synonyms: N'-[(E)-(3-bromophenyl)methylidene]-2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1C)N/N=C/c1cccc(c1)Br

STL004912
Synonyms: 6-methyl-6-(naphthalen-1-yl)-5,6-dihydrobenzimidazo[1,2-c]quinazoline
Smiles: CC1(Nc2ccccc2c2n1c1ccccc1n2)c1cccc2c1cccc2

STL004913
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1cn(nc1c1ccccc1)c1ccccc1

STL004914
Synonyms: (5Z)-5-{4-[3-(2-chlorophenoxy)propoxy]-3-methoxybenzylidene}-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1cc(ccc1OCCCOc1ccccc1Cl)/C=C\1/C(=O)NC(=O)N(C1=O)Cc1ccco1

STL004915
Synonyms: {2-[(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}aceticacid
Smiles: CCOc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1OCC(=O)O

STL004917
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-ethylphenyl)methylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N

STL004918
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-5-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1O)O

STL004919
Synonyms: benzyl(8S,8aR)-6-amino-5,7,7-tricyano-8-[2-(trifluoromethyl)phenyl]-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(=O)OCc1ccccc1)c1ccccc1C(F)(F)F)(C#N)C#N

STL004920
Synonyms: 2-chloro-7-(2-fluorophenyl)-6-(4-methylphenyl)-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)c2cc(Cl)ccc2OC1c1ccc(cc1)C)c1ccccc1F

STL004921
Synonyms: 3-(2-chloro-6-fluorobenzyl)-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)Cc1c(F)cccc1Cl

STL004922
Synonyms: 5-{(6-hydroxy-4-oxo-3-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl)[4-methoxy-3-(piperidinium-1-ylmethyl)phenyl]methyl}-6-oxo-1-phenyl-2-thioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccc(cc1C[NH+]1CCCCC1)C(c1c(O)[nH]c(=S)n(c1=O)c1ccccc1)c1c([O-])[nH]c(=S)n(c1=O)c1ccccc1

STL004923
Synonyms: 3-(2-chlorobenzyl)-9-(4-methoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1Cl

STL004924
Synonyms: 7-(4-ethoxyphenyl)-8-(3-methoxypropyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)OCC

STL004925
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]phenoxy}aceticacid
Smiles: OC(=O)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1cccs1)c1nonc1N

STL004926
Synonyms: N'-[(E)-{1-[2-(3,4-dimethylphenoxy)ethyl]-1H-indol-3-yl}methylidene]pyridine-4-carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1cn(c2c1cccc2)CCOc1ccc(c(c1)C)C

STL004928
Synonyms: 5-(4-ethoxyphenyl)-4-{[(E)-(2-methoxynaphthalen-1-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1)c1nnc(n1/N=C/c1c(OC)ccc2c1cccc2)S

STL004929
Synonyms: 7-butyl-8-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCn1c(N/N=C/c2ccccc2Cl)nc2c1c(=O)[nH]c(=O)n2C

STL004930
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-chlorophenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)Cl

STL004931
Synonyms: 3-(2-ethoxyethyl)-9-(3-methoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cccc(c1)OC

STL004932
Synonyms: N-[2-(2-{(Z)-[1-(3-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)c2cccc(c2)C)[nH]c2c1cccc2

STL004933
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(1E)-1-(furan-2-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccco1)\C

STL004934
Synonyms: 4-{2-(2-fluorophenyl)-4-hydroxy-3-[(4-nitrophenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}butanoicacid
Smiles: OC(=O)CCCN1C(=O)C(=C(C1c1ccccc1F)C(=O)c1ccc(cc1)[N+](=O)[O-])O

STL004935
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-[(E)-(5-methylthiophen-2-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(s1)C

STL004936
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(benzyloxy)phenyl]methylidene}-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)OCc1ccccc1

STL004937
Synonyms: N-(3,4-dichlorophenyl)-2-[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)COc1ccc2c(c1C)oc(=O)c(c2C)C

STL004938
Synonyms: ethyl4-{[5-oxo-4-(prop-2-en-1-yl)-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nnc2n1c1sc3c(c1c(=O)n2CC=C)CCCC3

STL004939
Synonyms: 7-(3,4-dichlorobenzyl)-1,3-dimethyl-8-[(3-methylbutyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCNc1nc2c(n1Cc1ccc(c(c1)Cl)Cl)c(=O)n(c(=O)n2C)C)C

STL004940
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(1E)-1-(2-ethoxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccccc1OCC)\C

STL004941
Synonyms: 7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-8-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCN1CCN(CC1)c1nc2c(n1CCSc1nc3c(s1)cccc3)c(=O)n(c(=O)n2C)C

STL004942
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-hydroxy-3-methoxyphenyl)ethylidene]-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(ccc1O)/C(=N/NC(=O)c1nnn(c1c1cccs1)c1nonc1N)/C

STL004943
Synonyms: 3-({4-chloro-5-[(E)-{2-[(2-methylphenoxy)acetyl]hydrazinylidene}methyl]-2-oxo-1,3-thiazol-3(2H)-yl}methyl)benzoicacid
Smiles: O=C(COc1ccccc1C)N/N=C/c1sc(=O)n(c1Cl)Cc1cccc(c1)C(=O)O

STL004944
Synonyms: 3-(4-fluorobenzyl)-1,7-dimethyl-9-(3-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(c2cccc(c2)C)c2n(C1)c1c(=O)n(Cc3ccc(cc3)F)c(=O)n(c1n2)C

STL004945
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dichlorophenyl)methylidene]-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

STL004947
Synonyms: 1-{4-[(5,7-dinitroquinolin-8-yl)amino]phenyl}ethanone
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c2c(c1Nc1ccc(cc1)C(=O)C)nccc2

STL004948
Synonyms: N-[({[(3E,8xi,9xi,14xi)-17-hydroxyandrost-4-en-3-ylidene]amino}oxy)acetyl]threonine
Smiles: O=C(NC(C(=O)O)C(O)C)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2O)C)C

STL004949
Synonyms: 1-(heptan-2-yl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-3-ol
Smiles: CCCCCC(n1nc(c2c1nc(C)cc2C)O)C

STL004950
Synonyms: N-(2,3-dimethylphenyl)-N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]butanamide
Smiles: CCCC(=O)N(c1cccc(c1C)C)Cc1cc2cccc(c2nc1O)C

STL004951
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]benzoicacid
Smiles: COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1C(=O)O

STL004952
Synonyms: 1-(2-chlorobenzyl)-3,7-dimethyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1Cn1c(=O)c2n(C)c(nc2n(c1=O)C)N/N=C/c1ccncc1

STL004953
Synonyms: 3-methyl-7-(naphthalen-1-ylmethyl)-8-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: [O-][N+](=O)c1ccc(cc1)/C=N/Nc1nc2c(n1Cc1cccc3c1cccc3)c(=O)[nH]c(=O)n2C

STL004954
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(1E)-1-(1,3-benzodioxol-5-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)/c1ccc2c(c1)OCO2

STL004955
Synonyms: 2-[(E)-{[3-(2-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]-6-methoxyphenol
Smiles: COc1cccc(c1O)/C=N/n1c(S)nnc1c1ccccc1Cl

STL004956
Synonyms: 3-methyl-7-(2-oxo-2-phenylethyl)-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(c1ccccc1)Cn1c(S)nc2c1c(=O)[nH]c(=O)n2C

STL004958
Synonyms: 5-{[6-hydroxy-3-(2-methoxyphenyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl](4-methoxy-3-{[2-(pyridin-3-yl)piperidinium-1-yl]methyl}phenyl)methyl}-1-(2-methoxyphenyl)-6-oxo-2-thioxo-1,2,3,6-tetr
Smiles: COc1ccc(cc1C[NH+]1CCCCC1c1cccnc1)C(c1c(O)[nH]c(=S)n(c1=O)c1ccccc1OC)c1c([O-])[nH]c(=S)n(c1=O)c1ccccc1OC

STL004959
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-[(E)-thiophen-2-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccs1

STL004960
Synonyms: 3-[(4-{[(9xi,11beta,14xi)-11,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl]oxy}-4-oxobutanoyl)amino]-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)propanoicacid
Smiles: O=C(NC(C1CCOC(C1)(C)C)CC(=O)O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)C[C@H](O)C1[C@H]2CCC2=CC(=O)C=C[C@]12C

STL004961
Synonyms: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(2-methoxybenzylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: COc1ccccc1/C=N/NC(=O)c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N

STL004962
Synonyms: 8-bromo-7-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)C(=O)Cn1c(Br)nc2c1c(=O)n(C)c(=O)n2C

STL004963
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(c(c1)OCC)O

STL004964
Synonyms: 10-(cyclopropylcarbonyl)-3-phenyl-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(CC2=C1C(c1cccs1)N(C(=O)C1CC1)c1c(N2)cccc1)c1ccccc1

STL004965
Synonyms: 7-(4-chlorophenyl)-8-(2-hydroxyphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(cc1)c1cn2c(n1c1ccccc1O)nc1c2c(=O)n(C)c(=O)n1C

STL004966
Synonyms: 2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-{4-[(E)-2-phenylethenyl]phenyl}ethanone
Smiles: COc1c2c(CCN(C2CC(=O)c2ccc(cc2)/C=C/c2ccccc2)C)cc2c1OCO2

STL004967
Synonyms: 5-(3-methylphenyl)-4-{[(E)-thiophen-2-ylmethylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Cc1cccc(c1)c1nnc(n1/N=C/c1cccs1)S

STL004968
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-biphenyl-4-ylmethylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)c1ccccc1)C

STL004969
Synonyms: furan-2-ylmethyl(2Z)-3-(1,3-benzodioxol-5-yl)-2-{[(4-methoxyphenyl)carbonyl]amino}prop-2-enoate
Smiles: COc1ccc(cc1)C(=O)N/C(=C\c1ccc2c(c1)OCO2)/C(=O)OCc1ccco1

STL004970
Synonyms: 1,7-dimethyl-3-(2-methylbenzyl)-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)Cc1ccccc1C

STL004971
Synonyms: 6-(3-methoxyphenyl)-1,3-dimethyl-5-(4-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: COc1cccc(c1)n1cc2c(c1c1ccc(cc1)C)c(=O)n(c(=O)n2C)C

STL004972
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-1-[(4-fluorophenyl)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)F)C)NC(=O)OC(C)(C)C

STL004973
Synonyms: 3-benzyl-9-(3,4-dimethylphenyl)-1,7-dimethyl-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)Cc1ccccc1

STL004974
Synonyms: 9a-{(E)-2-[4-(benzyloxy)phenyl]ethenyl}-9,9-dimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: O=C1CN2C(N1)(/C=C/c1ccc(cc1)OCc1ccccc1)C(c1c2cccc1)(C)C

STL004976
Synonyms: 5-[(Z)-(3-cyclopentyl-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)C2CCCC2)c(n(c1=O)C)N1CC(C)OC(C1)C

STL004977
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{2-[(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/c1ccccc1OCc1c(F)cccc1Cl)C

STL004978
Synonyms: 8-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(4-ethoxyphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCOc1ccc(cc1)c1cn2c(n1c1ccc3c(c1)OCCO3)nc1c2c(=O)n(C)c(=O)n1C

STL004979
Synonyms: 10-acetyl-3-(4-tert-butylphenyl)-11-(pyridin-3-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(CC2=C1C(c1cccnc1)N(C(=O)C)c1c(N2)cccc1)c1ccc(cc1)C(C)(C)C

STL004980
Synonyms: tert-butyl{(2S)-1-[4-({(2S)-1-[(2-methoxy-5-methylphenyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl}carbamate
Smiles: COc1ccc(cc1NC(=O)[C@@H](NC(=O)C1CCN(CC1)C(=O)[C@H](C(C)C)NC(=O)OC(C)(C)C)C)C

STL004981
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-methoxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N

STL004982
Synonyms: methyl3'-(2-chlorophenyl)-4-ethyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Smiles: COC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)CC)c1ccccc1)c1ccccc1Cl

STL004983
Synonyms: 9-(4-ethoxyphenyl)-1-methyl-3-(3-methylbutyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCOc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STL004984
Synonyms: 2-methoxy-4-[(1E)-1-(2-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazinylidene)ethyl]phenyl4-chlorobenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)Cl)/C(=N/NC(=O)CSc1nncn1C)/C

STL004985
Synonyms: 3-(4-methylphenyl)-6-phenyl[1,2,4]triazolo[3,4-a]phthalazine
Smiles: Cc1ccc(cc1)c1nnc2n1nc(c1ccccc1)c1c2cccc1

STL004986
Synonyms: (1Z)-N'-{[(2-chlorophenoxy)acetyl]oxy}-2-(naphthalen-1-yl)ethanimidamide
Smiles: O=C(COc1ccccc1Cl)O/N=C(/Cc1cccc2c1cccc2)\N

STL004987
Synonyms: (3E,8xi,14xi,17xi)-3-(2-carbamoylhydrazinylidene)-14-hydroxycard-20(22)-enolide
Smiles: NC(=O)N/N=C/1\CC[C@]2(C(C1)CCC1[C@@H]2CC[C@]2(C1(O)CCC2C1=CC(=O)OC1)C)C

STL004988
Synonyms: 2-[(E)-{[3-(3-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]-4,6-diiodophenol
Smiles: Clc1cccc(c1)c1nnc(n1/N=C/c1cc(I)cc(c1O)I)S

STL004989
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(1E)-1-(4-hydroxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)O)\C

STL004990
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(1E)-1-(naphthalen-2-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc2c(c1)cccc2)\C

STL004991
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(3,4-dimethoxyphenyl)ethylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(ccc1OC)/C(=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N)/C

STL004992
Synonyms: ethyl4-[(3-nitro-2-oxo-2H-chromen-4-yl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1c([N+](=O)[O-])c(=O)oc2c1cccc2

STL004993
Synonyms: 9-(4-chlorophenyl)-1-methyl-3-(3-phenylpropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Clc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCCc1ccccc1

STL004995
Synonyms: (5E)-5-{[(4-acetylphenyl)amino]methylidene}-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CC(=O)c1ccc(cc1)N/C=C/1\C(=O)NC(=O)N(C1=O)Cc1ccccc1

STL004996
Synonyms: N'-[(1E,2E)-3-(furan-2-yl)prop-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/c2ccco2)nc2c(c1=O)cccc2

STL004999
Synonyms: 5-[4-(dimethylamino)phenyl]-4-{[(E)-(2,4,5-trimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(OC)c(cc1/C=N/n1c(S)nnc1c1ccc(cc1)N(C)C)OC

STL005000
Synonyms: 5-({[4-(diethylamino)phenyl]amino}methylidene)-1,3-diethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=S)N(CC)C(=O)C(=CNc2ccc(cc2)N(CC)CC)C1=O

STL005001
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-[(E)-pyridin-3-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccnc1

STL005002
Synonyms: 3-hydroxy-4-[(4-methylphenyl)carbonyl]-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)C)O)C

STL005003
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(1E)-1-[4-(2-methylpropyl)phenyl]ethylidene}-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CC(Cc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/C)C

STL005004
Synonyms: 2-chloro-4-[(E)-2-cyano-2-{5-[(phenylcarbonyl)amino]-1,3,4-thiadiazol-2-yl}ethenyl]-6-methoxyphenyl4-methylbenzenesulfonate
Smiles: N#C/C(=C\c1cc(Cl)c(c(c1)OC)OS(=O)(=O)c1ccc(cc1)C)/c1nnc(s1)NC(=O)c1ccccc1

STL005006
Synonyms: 3-[(2,4-dimethylbenzyl)oxy]-2-[(2,4-dimethylbenzyl)sulfanyl]quinazolin-4(3H)-one
Smiles: Cc1ccc(c(c1)C)CSc1nc2ccccc2c(=O)n1OCc1ccc(cc1C)C

STL005007
Synonyms: (5Z)-5-(4-ethylbenzylidene)-2-[4-(3-methylphenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: CCc1ccc(cc1)/C=C/1\SC(=NC1=O)N1CCN(CC1)c1cccc(c1)C

STL005008
Synonyms: 2-{5-[(E)-(1-cyclopropyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2,4-dimethoxybenzyl}-1H-isoindole-1,3(2H)-dione
Smiles: COc1cc(OC)c(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C/1\C(=O)NC(=S)N(C1=O)C1CC1

STL005009
Synonyms: 1,7-dimethyl-3-(4-methylbenzyl)-9-(4-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(cc1)C

STL005010
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1O)O

STL005011
Synonyms: (5E)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-1-butyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCCCN1C(=S)NC(=O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C1=O

STL005012
Synonyms: 9-(3,5-dimethylphenyl)-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)c1cc(C)cc(c1)C

STL005013
Synonyms: N-[4-(diethylamino)benzyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzimidazol-2-amine
Smiles: CCN(c1ccc(cc1)CNc1nc2c(n1CCN1CCOCC1)cccc2)CC

STL005014
Synonyms: 1-{9-methyl-4-oxo-3-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxamide
Smiles: CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCC(CC2)C(=O)N)/C1=O

STL005015
Synonyms: 4-(4-chlorophenyl)-N-(4-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: COc1ccc(cc1)NC(=S)c1n2nc(n3c2c(c1c1ccc(cc1)Cl)CCCC3)c1ccccc1

STL005016
Synonyms: N-(4-ethoxyphenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nc(CC)nc2c1oc1c2cccc1

STL005017
Synonyms: (E)-N-[(7-benzyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]-1-(4-fluorophenyl)methanimine
Smiles: Fc1ccc(cc1)/C=N/OCc1nn2c(n1)c1cnn(c1nc2)Cc1ccccc1

STL005018
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-ethoxy-3-methoxyphenyl)ethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1OC)/C(=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N)/C

STL005019
Synonyms: 1,3-dimethyl-5-(4-methylphenyl)-6-pentyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: CCCCCn1cc2c(c1c1ccc(cc1)C)c(=O)n(c(=O)n2C)C

STL005020
Synonyms: 3-(3-methoxyphenyl)-2-[(E)-2-(naphthalen-1-yl)ethenyl]quinazolin-4(3H)-one
Smiles: COc1cccc(c1)n1c(/C=C/c2cccc3c2cccc3)nc2c(c1=O)cccc2

STL005021
Synonyms: 6-(3,4-dimethoxyphenyl)-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(c(c1)OC)OC

STL005022
Synonyms: N-[(2-hydroxyquinolin-3-yl)methyl]-3-methoxy-N-(3-methylphenyl)benzamide
Smiles: COc1cccc(c1)C(=O)N(c1cccc(c1)C)Cc1cc2ccccc2nc1O

STL005023
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-(5-methylfuran-2-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Cc1ccc(o1)/C=N/n1c(S)nnc1c1ccccc1F

STL005025
Synonyms: 2-{[3-cyano-6-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)NCCc1ccc(c(c1)OC)OC)c1ccc(c(c1)OC)OC

STL005026
Synonyms: (5E)-1-butyl-5-[(1-ethyl-1H-indol-3-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCCCN1C(=S)NC(=O)/C(=C\c2cn(c3c2cccc3)CC)/C1=O

STL005027
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(S)nnc1c1ccccc1Cl

STL005028
Synonyms: 4-(4-chlorobenzyl)-N-[(E)-(4-chloro-3-nitrophenyl)methylidene]piperazin-1-amine
Smiles: Clc1ccc(cc1)CN1CCN(CC1)/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl

STL005029
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-hydroxyphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Oc1cccc(c1)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N

STL005030
Synonyms: 5-{(Z)-[3-(3-methoxypropyl)-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: COCCCN1C(=S)S/C(=C\c2c(N3CCCCC3)n(C)c(=O)c(c2C)C#N)/C1=O

STL005031
Synonyms: 1-(4-bromobenzyl)-3,7-dimethyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)N/N=C/c1ccncc1

STL005032
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-(3-fluorophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)F)C

STL005033
Synonyms: 4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-5-(3-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1cccc(c1)c1nnc(n1/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl)S

STL005034
Synonyms: ethyl[1,7-dimethyl-9-(4-methylphenyl)-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)n1CC(C)CN(c1n2)c1ccc(cc1)C

STL005035
Synonyms: 2-(hexylsulfanyl)-4-(3-methylthiophen-2-yl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCCCCCSC1=C(C#N)C(CC(=O)N1)c1sccc1C

STL005036
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(1E)-1-(3,4-dimethoxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(ccc1OC)/C(=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)/C

STL005037
Synonyms: methyl1-(4-bromophenyl)-5-(3-chloro-2-methylphenyl)-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)c1ccc(cc1)Br

STL005038
Synonyms: (8xi,9xi,14xi)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl4-[(1-hydroxy-2-methylpropan-2-yl)amino]-4-oxobutanoate
Smiles: OCC(NC(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(O)C1C2CCC2=CC(=O)CC[C@]12C)(C)C

STL005039
Synonyms: ethyl5-(2,6-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)c1c(Cl)cccc1Cl)N=O

STL005040
Synonyms: 3-{6-chloro-3-[(3,5-dimethylphenyl)amino]imidazo[1,2-a]pyridin-2-yl}-6-methoxyquinolin-2-ol
Smiles: COc1ccc2c(c1)cc(c(n2)O)c1nc2n(c1Nc1cc(C)cc(c1)C)cc(cc2)Cl

STL005041
Synonyms: 4-[(4-bromophenyl)carbonyl]-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1-methyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1O)C1C(=C(C(=O)N1C)O)C(=O)c1ccc(cc1)Br

STL005042
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-5-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1c1cccc(c1)OC)c1nonc1N)OC

STL005043
Synonyms: ethyl4-{(Z)-[2-(furan-2-yl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenylcarbonate
Smiles: CCOC(=O)Oc1ccc(cc1)/C=C/1\N=C(OC1=O)c1ccco1

STL005044
Synonyms: 3-(1,3-benzothiazol-2-ylsulfanyl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]propanehydrazide
Smiles: COc1cc(/C=N/NC(=O)CCSc2nc3c(s2)cccc3)ccc1OC

STL005045
Synonyms: 3-benzyl-1-(2-{6-[(E)-(1-hexyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-1-methylthiourea
Smiles: CCCCCCN1C(=O)NC(=O)/C(=C\c2c(CCN(C(=S)NCc3ccccc3)C)cc3c(c2OC)OCO3)/C1=O

STL005046
Synonyms: 4-fluoro-N-[2,2,2-trichloro-1-(4-phenylpiperazin-1-yl)ethyl]benzamide
Smiles: Fc1ccc(cc1)C(=O)NC(C(Cl)(Cl)Cl)N1CCN(CC1)c1ccccc1

STL005047
Synonyms: (5E)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=S)NC(=O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C1=O

STL005048
Synonyms: 5-(3-methylphenyl)-4-{[(E)-(2-nitrophenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Cc1cccc(c1)c1nnc(n1/N=C/c1ccccc1[N+](=O)[O-])S

STL005049
Synonyms: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: O=C(c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N)N/N=C/c1ccc2c(c1)OCO2

STL005050
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N'-[(E)-(4-methylphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)C

STL005051
Synonyms: 1,4-bis[(6-chloropyridin-3-yl)sulfonyl]piperazine
Smiles: Clc1ccc(cn1)S(=O)(=O)N1CCN(CC1)S(=O)(=O)c1ccc(nc1)Cl

STL005052
Synonyms: 8-[(2-hydroxypropyl)sulfanyl]-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CSc1nc2c(n1Cc1cccc3c1cccc3)c(=O)n(c(=O)n2C)C)O

STL005053
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(2-methoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1OC

STL005054
Synonyms: 8-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]-3-methyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1cccc3c1cccc3)c(=O)[nH]c(=O)n2C

STL005055
Synonyms: 1-[1-(4-ethoxyphenyl)-1-oxopropan-2-yl]-3-(4-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium
Smiles: CCOc1ccc(cc1)C(=O)C([n+]1cc(n2c1CCC2)c1ccc(cc1)OC)C

STL005056
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1C(F)(F)F

STL005057
Synonyms: 8-{[3-(dimethylamino)propyl]amino}-1,3-dimethyl-7-(4-nitrobenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN(CCCNc1nc2c(n1Cc1ccc(cc1)[N+](=O)[O-])c(=O)n(c(=O)n2C)C)C

STL005058
Synonyms: 8-benzyl-1-[(4-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(Cc3sc2n2c1nnc2SCc1ccc(cc1)Cl)Cc1ccccc1

STL005059
Synonyms: N-(2,3-dichlorophenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)Nc2cccc(c2Cl)Cl)c2c(n1)c1ccccc1o2

STL005060
Synonyms: 1,7-dimethyl-9-(4-methylphenyl)-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)c1ccc(cc1)C)C

STL005061
Synonyms: (12bS)-7-(2-chlorophenyl)-12b-methyl-2-(2-phenylethyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCc1ccccc1

STL005062
Synonyms: 5-(pyridin-2-yl)-4-{[(E)-(2,4,6-trimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(OC)c(c(c1)OC)/C=N/n1c(S)nnc1c1ccccn1

STL005063
Synonyms: 1,7-dimethyl-3-(2-methylbenzyl)-9-(4-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(c2ccc(cc2)C)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)Cc1ccccc1C

STL005064
Synonyms: 3-{4-[(5E)-5-{[5-(2,4-dichlorophenyl)furan-2-yl]methylidene}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}propanenitrile
Smiles: N#CCCN1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(o2)c2ccc(cc2Cl)Cl)/S1

STL005065
Synonyms: 3-(1H-benzimidazol-1-yl)-N'-[(E)-pyridin-4-ylmethylidene]propanehydrazide
Smiles: O=C(CCn1cnc2c1cccc2)N/N=C/c1ccncc1

STL005066
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dimethoxyphenyl)methylidene]-5-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(c(c1)OC)/C=N/NC(=O)c1nnn(c1c1cccc(c1)OC)c1nonc1N

STL005067
Synonyms: propan-2-yl(2Z)-3-(1,3-benzodioxol-5-yl)-2-({[4-(2-methylpropoxy)phenyl]carbonyl}amino)prop-2-enoate
Smiles: CC(COc1ccc(cc1)C(=O)N/C(=C\c1ccc2c(c1)OCO2)/C(=O)OC(C)C)C

STL005068
Synonyms: 2,2'-[piperazine-1,4-diylbis(3-oxopropane-3,1-diyl)]bis(5-chloro-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione)
Smiles: ClC1=CCC2C(C1)C(=O)N(C2=O)CCC(=O)N1CCN(CC1)C(=O)CCN1C(=O)C2C(C1=O)CC(=CC2)Cl

STL005070
Synonyms: 3-(3-chlorophenyl)-5-{[3-(3-chlorophenyl)-6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl][4-methoxy-3-(pyrrolidinium-1-ylmethyl)phenyl]methyl}-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)c1cccc(c1)Cl)c1c(=O)[nH]c(=S)n(c1[O-])c1cccc(c1)Cl

STL005071
Synonyms: 10a-[(E)-2-{4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: COc1cc(ccc1OCc1ccccc1Cl)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1

STL005072
Synonyms: (5E)-5-{[1-(2-chlorobenzyl)-1H-indol-3-yl]methylidene}-1-ethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=S)NC(=O)/C(=C\c2cn(c3c2cccc3)Cc2ccccc2Cl)/C1=O

STL005073
Synonyms: N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]-2-(4-nitro-1H-pyrazol-1-yl)acetohydrazide
Smiles: O=C(Cn1ncc(c1)[N+](=O)[O-])N/N=C/c1cc(Br)ccc1O

STL005074
Synonyms: tetramethyl5',5',7'-trimethyl-6'-[(2E)-3-(4-nitrophenyl)prop-2-enoyl]-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Smiles: COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3cccc1C)C(=O)/C=C/c1ccc(cc1)[N+](=O)[O-])SC(=C(S2)C(=O)OC)C(=O)OC

STL005075
Synonyms: {2-(4-fluorophenyl)-4-hydroxy-3-[(4-nitrophenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}aceticacid
Smiles: OC(=O)CN1C(c2ccc(cc2)F)C(=C(C1=O)O)C(=O)c1ccc(cc1)[N+](=O)[O-]

STL005076
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-phenylpropylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CC/C(=N\NC(=O)c1nnn(c1C(C)C)c1nonc1N)/c1ccccc1

STL005077
Synonyms: 4-chloro-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-N-(2-methoxyphenyl)benzamide
Smiles: COc1ccccc1N(C(=O)c1ccc(cc1)Cl)Cc1cc2cc(C)ccc2nc1O

STL005078
Synonyms: 3-(2-chlorobenzyl)-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)Cc1ccccc1Cl

STL005079
Synonyms: 4-[(4-ethoxyphenyl)carbonyl]-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-hydroxy-5-(2-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1OC)c1sc2c(n1)ccc(c2)CC

STL005080
Synonyms: 2-{(Z)-[2-(4-methylpiperazin-1-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}phenylbenzenesulfonate
Smiles: CN1CCN(CC1)C1=NC(=O)/C(=C/c2ccccc2OS(=O)(=O)c2ccccc2)/S1

STL005081
Synonyms: 1-(4-bromophenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone
Smiles: CCc1nc(SCC(=O)c2ccc(cc2)Br)c2c(n1)c1ccccc1o2

STL005083
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-ethoxyphenyl)ethylidene]-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CSc1ccc(cc1)C)c1nonc1N)/C

STL005084
Synonyms: (4Z)-4-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-(4-ethylphenyl)-1,3-oxazol-5(4H)-one
Smiles: CCc1ccc(cc1)C1=N/C(=C\c2c(C)nn(c2Cl)c2ccccc2)/C(=O)O1

STL005085
Synonyms: 4-{(1E)-1-[2-({[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetyl)hydrazinylidene]ethyl}phenylacetate
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1C)N/N=C(/c1ccc(cc1)OC(=O)C)\C

STL005086
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Smiles: COc1ccc(c(c1)OC)NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCCC3

STL005087
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-hydroxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CSc1ccccc1)C(=O)N/N=C/c1ccccc1O

STL005088
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dimethoxyphenyl)methylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1OC)OC

STL005089
Synonyms: 6-(3-chloro-4-methylphenyl)-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)c1ccc(c(c1)Cl)C

STL005090
Synonyms: 5-(4-bromophenyl)-3-hydroxy-1-phenyl-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Brc1ccc(cc1)C1C(=C(C(=O)N1c1ccccc1)O)C(=O)/C=C/c1ccccc1

STL005091
Synonyms: 3-(3-hydroxyphenyl)-2-[(E)-2-(2-methylphenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Oc1cccc(c1)n1c(/C=C/c2ccccc2C)nc2c(c1=O)cccc2

STL005092
Synonyms: N-{4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenyl}acetamide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)NC(=O)C

STL005093
Synonyms: 4-{[(E)-(5-bromo-2-fluorophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1)c1nnc(n1/N=C/c1cc(Br)ccc1F)S

STL005095
Synonyms: 4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1)c1nnc(n1/N=C/c1ccc(cc1)N(C)C)S

STL005096
Synonyms: N-[1-(1,3-benzothiazol-2-ylamino)-2,2,2-trichloroethyl]thiophene-2-carboxamide
Smiles: O=C(c1cccs1)NC(C(Cl)(Cl)Cl)Nc1nc2c(s1)cccc2

STL005097
Synonyms: 4-{3-[(5Z)-5-(4-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-2,5-dioxopyrrolidin-1-yl}benzoicacid
Smiles: Clc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)C1CC(=O)N(C1=O)c1ccc(cc1)C(=O)O

STL005098
Synonyms: N-(2,3-dimethylphenyl)-N-[(2-hydroxy-8-methylquinolin-3-yl)methyl]benzamide
Smiles: Oc1nc2c(cc1CN(c1cccc(c1C)C)C(=O)c1ccccc1)cccc2C

STL005099
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-ethoxy-3-methoxyphenyl)ethylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(c(c1)OC)OCC)\C

STL005100
Synonyms: 9-(2-methoxyphenyl)-2-phenyltetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Smiles: COc1ccccc1C1N2CCCN2C2C1C(=O)N(C2=O)c1ccccc1

STL005101
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-methylphenyl)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)C

STL005102
Synonyms: 8-(heptylsulfanyl)-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCSc1nc2c(n1CC(COc1ccccc1)O)c(=O)[nH]c(=O)n2C

STL005103
Synonyms: 5-[4-(dimethylamino)phenyl]-4-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(c(c1OC)OC)/C=N/n1c(S)nnc1c1ccc(cc1)N(C)C

STL005104
Synonyms: methylN-(4-{[(8xi,9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl]oxy}-4-oxobutanoyl)-3-nitrotyrosinate
Smiles: COC(=O)C(Cc1ccc(c(c1)[N+](=O)[O-])O)NC(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C

STL005105
Synonyms: 6-(4-fluorobenzyl)-1,3-dimethyl-5-(3-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Fc1ccc(cc1)Cn1cc2c(c1c1cccc(c1)C)c(=O)n(c(=O)n2C)C

STL005107
Synonyms: (5Z)-1-(4-ethoxyphenyl)-5-[(piperidin-1-ylamino)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=S)NC(=O)/C(=C/NN2CCCCC2)/C1=O

STL005108
Synonyms: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3,4,5-triethoxybenzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)Nc1nnc(s1)c1ccccc1Cl

STL005110
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(2,4,6-trimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(OC)c(c(c1)OC)/C=N/n1c(S)nnc1c1ccccc1Cl

STL005111
Synonyms: 1-(4-hydroxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)thiourea
Smiles: S=C(NC1(C)CCS(=O)(=O)C1)Nc1ccc(cc1)O

STL005112
Synonyms: 1-{5-[(3,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-(4-ethoxyphenyl)urea
Smiles: CCOc1ccc(cc1)NC(=O)Nc1nnc(s1)COc1ccc(c(c1)C)C

STL005113
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxy-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)ccc1O

STL005114
Synonyms: 2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoicacid
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1C(=O)O

STL005115
Synonyms: 6-(4-benzylpiperidin-1-yl)-1,4-dimethyl-2-oxo-5-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,2-dihydropyridine-3-carbonitrile
Smiles: CCCN1C(=S)S/C(=C\c2c(C)c(C#N)c(=O)n(c2N2CCC(CC2)Cc2ccccc2)C)/C1=O

STL005116
Synonyms: 4-chloro-N-(2-{2-[(3,4-dimethylphenyl)amino]-4,4-dimethyl-6-oxocyclohex-1-en-1-yl}-1,1,1,3,3,3-hexafluoropropan-2-yl)benzamide
Smiles: Clc1ccc(cc1)C(=O)NC(C(F)(F)F)(C(F)(F)F)C1=C(Nc2ccc(c(c2)C)C)CC(CC1=O)(C)C

STL005118
Synonyms: N-(2,5-dimethoxyphenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: COc1ccc(c(c1)NC(=O)CSc1nc(CC)nc2c1oc1c2cccc1)OC

STL005119
Synonyms: N-{[(2R)-2-hydroxy-2-(3-methoxyphenyl)cyclohexyl]methyl}-N,N-dimethylethanaminium
Smiles: COc1cccc(c1)[C@@]1(O)CCCCC1C[N+](CC)(C)C

STL005120
Synonyms: 7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-8-(ethylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCSc1nc2c(n1CC(COc1ccc(cc1)CC)O)c(=O)[nH]c(=O)n2C

STL005122
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-5-(3-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1OC)OC

STL005123
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CSc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N

STL005124
Synonyms: methyl6'-amino-1-(2,4-dichlorobenzyl)-3'-methyl-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carboxylate
Smiles: COC(=O)C1=C(N)Oc2c(C31c1ccccc1N(C3=O)Cc1ccc(cc1Cl)Cl)c(C)n[nH]2

STL005126
Synonyms: N-(3-chloro-4-methylphenyl)-2-oxo-2-{(2E)-2-[1-(pyridin-4-yl)ethylidene]hydrazinyl}acetamide
Smiles: O=C(C(=O)N/N=C(/c1ccncc1)\C)Nc1ccc(c(c1)Cl)C

STL005127
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(4-ethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1)/C=N/n1c(S)nnc1c1cccc(c1)Cl

STL005128
Synonyms: 2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCC3

STL005129
Synonyms: (4Z)-2-(2-bromophenyl)-4-(4-methoxy-3-nitrobenzylidene)-1,3-oxazol-5(4H)-one
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\N=C(OC1=O)c1ccccc1Br

STL005130
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Oc1ccc(c(c1)O)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N

STL005131
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-hydroxyphenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1N)N/N=C/c1ccccc1O

STL005132
Synonyms: 9-(4-ethylphenyl)-1-methyl-3-(3-methylbutyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STL005133
Synonyms: 7-(4-chlorophenyl)-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)c1ccc(cc1)Cl

STL005134
Synonyms: 9-(4-bromophenyl)-3-(2-chlorobenzyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Brc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1Cl

STL005135
Synonyms: 5-(4-chloro-3-nitrophenyl)-3-(4-hydroxyphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Oc1ccc(cc1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)c1ccc(c(c1)[N+](=O)[O-])Cl

STL005136
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1N

STL005137
Synonyms: 8-[(3-ethoxypropyl)amino]-7-(2-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCOCCCNc1nc2c(n1Cc1ccccc1F)c(=O)n(c(=O)n2C)C

STL005138
Synonyms: (8xi,9xi,14xi)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl4-oxo-4-[(1-phenylethyl)amino]butanoate
Smiles: O=C(NC(c1ccccc1)C)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(O)C1C2CCC2=CC(=O)CC[C@]12C

STL005139
Synonyms: 1-(2,4-dichlorobenzyl)-2-(2-methylpropyl)-1H-benzimidazole
Smiles: CC(Cc1nc2c(n1Cc1ccc(cc1Cl)Cl)cccc2)C

STL005140
Synonyms: N-(4-bromophenyl)-2-{[3-cyano-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: COc1cc(cc(c1OC)OC)C1C(=C(SCC(=O)Nc2ccc(cc2)Br)NC2=C1C(=O)CCC2)C#N

STL005142
Synonyms: (4Z)-4-[(1-acetyl-3-phenyl-1H-pyrazol-4-yl)methylidene]-2-(2,5-dichlorophenyl)-1,3-oxazol-5(4H)-one
Smiles: Clc1ccc(c(c1)C1=N/C(=C\c2cn(nc2c2ccccc2)C(=O)C)/C(=O)O1)Cl

STL005143
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccc(cc2)C)c2nonc2N)ccc1O

STL005144
Synonyms: (5E)-1-(3-chlorophenyl)-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Clc1cccc(c1)N1C(=S)NC(=O)/C(=C\NCCCn2ccnc2)/C1=O

STL005145
Synonyms: methyl{[3-cyano-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc(cc(c1C#N)C(F)(F)F)C12CC3CC(C2)CC(C1)C3

STL005146
Synonyms: 4-amino-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-1,2,5-oxadiazole-3-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nonc2N)ccc1O

STL005147
Synonyms: N-[2-hydroxy-3-(2-methyl-1H-benzimidazol-1-yl)propyl]-N-(2-methoxyphenyl)benzenesulfonamide
Smiles: COc1ccccc1N(S(=O)(=O)c1ccccc1)CC(Cn1c(C)nc2c1cccc2)O

STL005148
Synonyms: 5-(4-ethoxyphenyl)-4-{(2E)-2-[(5-methylfuran-2-yl)methylidene]hydrazinyl}-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1)c1nnc(n1N/N=C/c1ccc(o1)C)S

STL005149
Synonyms: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-({(2E)-2-[(5-methylthiophen-2-yl)methylidene]hydrazinyl}carbonyl)-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: Cc1ccc(s1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N

STL005150
Synonyms: 9-(3,4-dimethylphenyl)-3-(2-methoxyethyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(c(c1)C)C

STL005151
Synonyms: 1-butyl-N-(3,4,5-trimethoxybenzyl)-1H-benzimidazol-2-amine
Smiles: CCCCn1c(NCc2cc(OC)c(c(c2)OC)OC)nc2c1cccc2

STL005152
Synonyms: 2-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}benzoicacid
Smiles: Nc1nonc1n1nnc(c1CSc1ccccc1)C(=O)N/N=C/c1ccccc1C(=O)O

STL005153
Synonyms: N-[1-(4-chlorophenyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-3,4-dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)NC1(NC(=O)N(C1=O)c1ccc(cc1)Cl)C(F)(F)F

STL005154
Synonyms: 1-[4-(4-chlorophenyl)-1-hydroxy-2,5,5-trimethyl-3-oxido-2,5-dihydro-1H-imidazol-2-yl]ethanone
Smiles: ON1C(C)(C)C(=[N+](C1(C)C(=O)C)[O-])c1ccc(cc1)Cl

STL005156
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(c(c2OC)OC)OC)nc2c(c1=O)cccc2

STL005157
Synonyms: N-tert-butyl-2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
Smiles: Cc1nn2c(nnc2c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NC(C)(C)C)C

STL005158
Synonyms: 3-chloro-N-{4-[4-(2-chlorobenzyl)piperazin-1-yl]phenyl}-1-benzothiophene-2-carboxamide
Smiles: Clc1ccccc1CN1CCN(CC1)c1ccc(cc1)NC(=O)c1sc2c(c1Cl)cccc2

STL005159
Synonyms: 1,3-dimethyl-8-(morpholin-4-ylmethyl)-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n(Cc1cccc3c1cccc3)c(n2)CN1CCOCC1

STL005160
Synonyms: 10,10-dichloro-N-(4-chlorophenyl)tricyclo[7.1.0.0~4,6~]decane-5-carboxamide
Smiles: O=C(C1C2C1CCC1C(CC2)C1(Cl)Cl)Nc1ccc(cc1)Cl

STL005161
Synonyms: N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-2-methyl-N-phenylbenzamide
Smiles: Cc1ccc2c(c1)cc(c(n2)O)CN(C(=O)c1ccccc1C)c1ccccc1

STL005162
Synonyms: 8-(3-methoxypropyl)-7-{4-[(3-methoxypropyl)amino]phenyl}-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)NCCCOC

STL005163
Synonyms: N-benzyl-2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
Smiles: Cc1nn2c(nnc2c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NCc1ccccc1)C

STL005164
Synonyms: 10a-{(E)-2-[4-(benzyloxy)-3-methoxyphenyl]ethenyl}-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: COc1cc(ccc1OCc1ccccc1)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1

STL005165
Synonyms: (5Z)-5-[(cyclopropylamino)methylidene]-1-(2,4-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)NC(=O)/C(=C/NC2CC2)/C1=O

STL005166
Synonyms: 2-(3,5-dimethylpiperidin-1-yl)-3-[(1E)-1-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)ethyl]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCN1C(=S)S/C(=C(/c2c(nc3n(c2=O)cc(cc3)C)N2CC(C)CC(C2)C)\C)/C1=O

STL005167
Synonyms: 2-chloro-N-{2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethyl}acetamide
Smiles: ClCC(=O)NCCC1C(C1(C)C)c1c(C)[nH]c2c1cccc2

STL005168
Synonyms: 7-[(2E)-3-chlorobut-2-en-1-yl]-1,3-dimethyl-8-[(2E)-2-(1-phenylethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C(=C\Cn1c(N/N=C(/c2ccccc2)\C)nc2c1c(=O)n(c(=O)n2C)C)/Cl

STL005169
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(diethylamino)-2-hydroxyphenyl]methylidene}-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(c1ccc(c(c1)O)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)CC

STL005170
Synonyms: (3S,7Z,11E)-16-hydroxy-7-(hydroxyimino)-14-methoxy-3-methyl-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-1-one
Smiles: O/N=C\1/CCC/C=C/c2cc(OC)cc(c2C(=O)O[C@H](CCC1)C)O

STL005171
Synonyms: N-[1-(3-chloro-4-fluorophenyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC1(NC(=O)N(C1=O)c1ccc(c(c1)Cl)F)C(F)(F)F

STL005172
Synonyms: 5-(2-chlorophenyl)-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Smiles: CN(c1ccc(cc1)/C=N/n1c(S)nnc1c1ccccc1Cl)C

STL005173
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dichlorophenyl)methylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1Cl)Cl

STL005174
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1O)O

STL005175
Synonyms: 5-(3-chlorophenyl)-4-({(E)-[4-(diethylamino)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Smiles: CCN(c1ccc(cc1)/C=N/n1c(S)nnc1c1cccc(c1)Cl)CC

STL005177
Synonyms: methyl4-{3-[(4-chlorophenyl)carbonyl]-4-hydroxy-1-[3-(morpholin-4-yl)propyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1ccc(cc1)Cl)O

STL005178
Synonyms: 1,7-dimethyl-3-(3-methylbutyl)-9-(3-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)c1cccc(c1)C)C

STL005179
Synonyms: 4,7,7-trimethyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: O=C(c1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2C)CC(OC3)(C)C

STL005180
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dichlorophenyl)methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1Cl)Cl)C

STL005181
Synonyms: 3-(2,5-dimethylbenzyl)-1-methyl-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Cc1ccc(c(c1)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccccc1)C

STL005182
Synonyms: N-[5-(2-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-4-nitrobenzamide
Smiles: COc1ccccc1c1nnc(s1)NC(=O)c1ccc(cc1)[N+](=O)[O-]

STL005183
Synonyms: 3-chloro-N-[5-(1-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: CCC(c1nnc(s1)NC(=O)c1cccc(c1)Cl)c1ccccc1

STL005184
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-ethoxy-3-methoxyphenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1OC)/C(=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/C

STL005185
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/C(=C/c1ccccc1)/C

STL005187
Synonyms: 1-[(E)-{[3-(3-methoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]naphthalen-2-ol
Smiles: COc1cccc(c1)c1nnc(n1/N=C/c1c(O)ccc2c1cccc2)S

STL005188
Synonyms: butyl2'-amino-5-bromo-2,5'-dioxo-1,2-dihydro-5'H-spiro[indole-3,4'-pyrano[3,2-c]chromene]-3'-carboxylate
Smiles: CCCCOC(=O)C1=C(N)Oc2c(C31C(=O)Nc1c3cc(Br)cc1)c(=O)oc1c2cccc1

STL005189
Synonyms: (5E)-1-benzyl-5-({[4-(morpholin-4-ylmethyl)phenyl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/Nc1ccc(cc1)CN1CCOCC1)Cc1ccccc1

STL005190
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CSc1nncn1C)c1nonc1N)N/N=C/c1ccc(cc1)C(F)(F)F

STL005191
Synonyms: 5-(3-methylphenyl)-3-(naphthalen-1-yl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Cc1cccc(c1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1cccc2c1cccc2

STL005192
Synonyms: 1-(1-benzylpiperidin-4-yl)butan-1-one
Smiles: CCCC(=O)C1CCN(CC1)Cc1ccccc1

STL005193
Synonyms: 3-({1-[1-(4-chlorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-1-oxobutan-2-yl}oxy)-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Smiles: CCC(C(=O)N1CCC2(C(C1c1ccc(cc1)Cl)CCCC2)O)Oc1ccc2c(c1)oc(=O)c1c2CCCC1

STL005194
Synonyms: N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-N-phenylbenzamide
Smiles: Cc1ccc2c(c1)nc(c(c2)CN(C(=O)c1ccccc1)c1ccccc1)O

STL005195
Synonyms: 3-cyclopentyl-5-(2-methylpropyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl3-methylbutanoate
Smiles: CC(CC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CC(C)C)cccc3)C1CCCC1)C

STL005196
Synonyms: 6-hydroxy-3-(3-methylphenyl)-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: Cc1cccc(c1)n1c(=S)[nH]c(c(c1=O)C1NCCc2c1[nH]c1c2cccc1)O

STL005197
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(diethylamino)-2-hydroxyphenyl]methylidene}-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(c1ccc(c(c1)O)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1N)CC

STL005198
Synonyms: 5-({1-[2-(2-fluorophenoxy)ethyl]-1H-indol-3-yl}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1NC(=O)C(=Cc2cn(c3c2cccc3)CCOc2ccccc2F)C(=O)N1

STL005199
Synonyms: (5E)-1-ethyl-5-({1-[2-(2-methoxyphenoxy)ethyl]-1H-indol-3-yl}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=S)NC(=O)/C(=C\c2cn(c3c2cccc3)CCOc2ccccc2OC)/C1=O

STL005200
Synonyms: 3-{3-[(3-chloro-2-methylphenyl)amino]imidazo[1,2-a]pyridin-2-yl}-6-methoxyquinolin-2-ol
Smiles: COc1ccc2c(c1)cc(c(n2)O)c1nc2n(c1Nc1cccc(c1C)Cl)cccc2

STL005201
Synonyms: (5Z)-2-(phenylamino)-5-(pyridin-4-ylmethylidene)-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C\c1ccncc1)Nc1ccccc1

STL005202
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(5-chlorothiophen-2-yl)ethylidene]-5-(3,4-dichlorophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(s1)/C(=N/NC(=O)c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)/C

STL005203
Synonyms: methyl(3S)-2-{[(3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate
Smiles: COC(=O)[C@@H]1Cc2c(CN1C(=O)COc1ccc3c(c1C)oc(=O)c(c3C)Cc1ccccc1)[nH]c1c2cccc1

STL005204
Synonyms: 1-(2,4-dimethylphenyl)-N-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Smiles: Cc1ccc(c(c1)C)n1ncc2c1ncnc2Nc1ccccc1C

STL005205
Synonyms: (4Z)-4-[2-(benzyloxy)benzylidene]-2-(2-chloro-4,5-difluorophenyl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccccc1OCc1ccccc1)c1cc(F)c(cc1Cl)F

STL005206
Synonyms: 6-(4-ethylpiperazin-1-yl)-5-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: CCCCCCN1C(=S)S/C(=C\c2c(C)c(C#N)c(=O)n(c2N2CCN(CC2)CC)C)/C1=O

STL005207
Synonyms: N'-[(E)-(4-ethoxyphenyl)methylidene]-2-{[3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)CSc1nc2ccccc2c(=O)n1c1ccccc1C

STL005208
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(2E,3E)-4-[4-(dimethylamino)phenyl]but-3-en-2-ylidene}-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/C=C/c1ccc(cc1)N(C)C

STL005209
Synonyms: 4-chloro-N-(2,4-dimethylphenyl)-N-[(2-hydroxyquinolin-3-yl)methyl]benzamide
Smiles: Cc1ccc(c(c1)C)N(C(=O)c1ccc(cc1)Cl)Cc1cc2ccccc2nc1O

STL005211
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(1E,2E)-2-methyl-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)/C

STL005212
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-phenylmethylidene]acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccccc2)nc2c(c1=O)cccc2

STL005213
Synonyms: 9-(3,5-dimethylphenyl)-3-(2-fluorobenzyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(c2cc(C)cc(c2)C)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)Cc1ccccc1F

STL005214
Synonyms: N-[4-oxo-5-(propan-2-yl)-4,5-dihydro-1,3-thiazol-2-yl]undec-10-enamide
Smiles: C=CCCCCCCCCC(=O)NC1=NC(=O)C(S1)C(C)C

STL005215
Synonyms: ethyl2-(1,3-dimethyl-2,4-dioxo-5-phenyl-1,2,3,4-tetrahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl)benzoate
Smiles: CCOC(=O)c1ccccc1n1cc2c(c1c1ccccc1)c(=O)n(c(=O)n2C)C

STL005216
Synonyms: 5-(4-tert-butylphenyl)-3-hydroxy-4-[(4-methoxy-3-methylphenyl)carbonyl]-1-(5-methyl-1,2-oxazol-3-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1C)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)c1noc(c1)C

STL005217
Synonyms: ethyl[9-(4-ethoxyphenyl)-1,7-dimethyl-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)n1CC(C)CN(c1n2)c1ccc(cc1)OCC

STL005218
Synonyms: 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-N'-[(E)-thiophen-2-ylmethylidene]acetohydrazide
Smiles: O=C(Cn1c(nc2c1cccc2)c1nonc1N)N/N=C/c1cccs1

STL005219
Synonyms: N-benzyl-7-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Smiles: [O-][N+](=O)c1c(NCc2ccccc2)cc(c2c1non2)N1CCc2c(C1)cccc2

STL005220
Synonyms: 7-(4-ethoxyphenyl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCOc1ccc(cc1)c1cn2c(n1c1ccc(cc1)C(C)C)nc1c2c(=O)n(C)c(=O)n1C

STL005221
Synonyms: 6-{[(2Z)-3-(furan-2-yl)-2-{[(2E)-3-phenylprop-2-enoyl]amino}prop-2-enoyl]amino}hexanoicacid
Smiles: OC(=O)CCCCCNC(=O)/C(=C/c1ccco1)/NC(=O)/C=C/c1ccccc1

STL005222
Synonyms: 8-[(4-methoxybenzyl)amino]-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(NCc2ccc(cc2)OC)nc2c1c(=O)[nH]c(=O)n2C

STL005223
Synonyms: 3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-{[4-(prop-2-en-1-yloxy)phenyl]carbonyl}-5-(pyridin-3-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: C=CCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccnc1)CCCn1cncc1

STL005224
Synonyms: 5-benzyl-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: COc1cc(cc(c1O)Br)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)Cc1ccccc1

STL005225
Synonyms: (4Z)-4-{[5-(2,4-dichlorophenyl)furan-2-yl]methylidene}-2-(3-nitrophenyl)-1,3-oxazol-5(4H)-one
Smiles: Clc1ccc(c(c1)Cl)c1ccc(o1)/C=C/1\N=C(OC1=O)c1cccc(c1)[N+](=O)[O-]

STL005226
Synonyms: 6-(4-methylphenyl)-10-(methylsulfanyl)-7-(thiophen-2-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nn2c(n1)NC1=C(C2c2cccs2)C(Oc2c1cccc2)c1ccc(cc1)C

STL005227
Synonyms: methyl3-acetyl-8-methyl-1-(4-methylphenyl)-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-7-carboxylate
Smiles: COC(=O)C1=C(C)N(C2(S1)SC(=NN2c1ccc(cc1)C)C(=O)C)c1ccccc1

STL005228
Synonyms: (5E)-1-(furan-2-ylmethyl)-5-{[(thiophen-2-ylmethyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/NCc1cccs1)Cc1ccco1

STL005229
Synonyms: bis(2-methylpropyl)diethylphosphoramidate
Smiles: CCN(P(=O)(OCC(C)C)OCC(C)C)CC

STL005230
Synonyms: N-(2,5-dimethylphenyl)-1-heptyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCCCCn1c(=O)c(C(=O)Nc2cc(C)ccc2C)c(c2c1cccc2)O

STL005231
Synonyms: bis(2-methylpropyl)4-hydroxy-4-methyl-2-(3-nitrophenyl)-6-oxocyclohexane-1,3-dicarboxylate
Smiles: CC(COC(=O)C1C(=O)CC(C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OCC(C)C)(C)O)C

STL005232
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dichlorophenyl)-N'-[(1E)-1-(4-hydroxy-3-methoxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(ccc1O)/C(=N/NC(=O)c1nnn(c1c1ccc(c(c1)Cl)Cl)c1nonc1N)/C

STL005233
Synonyms: 5-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-6-(4-methylpiperazin-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: CCCCCCN1C(=S)S/C(=C\c2c(N3CCN(CC3)C)n(C)c(=O)c(c2C)C#N)/C1=O

STL005234
Synonyms: 8-[benzyl(2-hydroxyethyl)amino]-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCN(c1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C)Cc1ccccc1

STL005235
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-pyridin-3-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccnc1

STL005236
Synonyms: 4-acetyl-3-hydroxy-1-(3-hydroxypropyl)-5-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: OCCCN1C(c2ccccc2)C(=C(C1=O)O)C(=O)C

STL005238
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(2,4,6-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1c(OC)cc(cc1OC)OC

STL005239
Synonyms: 1-(4-bromophenyl)-4-[(4-bromophenyl)carbonyl]-5-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)C1N(c2ccc(cc2)Br)C(=O)C(=C1C(=O)c1ccc(cc1)Br)O

STL005241
Synonyms: 1-amino-N-(3,4-dimethoxyphenyl)piperidine-2-carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)C1CCCCN1N

STL005242
Synonyms: 5-(4-fluorophenyl)-3-hydroxy-1-phenyl-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)C1C(=C(C(=O)N1c1ccccc1)O)C(=O)/C=C/c1ccccc1

STL005243
Synonyms: methyl2-{[{(2E)-2-[1-(2,4-dihydroxyphenyl)ethylidene]hydrazinyl}(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)C(=O)N/N=C(/c2ccc(cc2O)O)\C)sc2c1CCCC2

STL005244
Synonyms: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(2-hydroxy-3-methoxybenzylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: COc1cccc(c1O)/C=N/NC(=O)c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N

STL005245
Synonyms: 8-[(3-methoxypropyl)amino]-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCCNc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STL005247
Synonyms: 2-(5-ethyl-5,6-dihydrobenzimidazo[1,2-c]quinazolin-6-yl)-4-nitrophenol
Smiles: CCN1c2ccccc2c2n(C1c1cc(ccc1O)[N+](=O)[O-])c1ccccc1n2

STL005248
Synonyms: ethyl[6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate
Smiles: CCOC(=O)Cc1n[nH]c2c1C1(C(=C(O2)N)C#N)c2ccccc2N(C1=O)Cc1ccc(cc1)Cl

STL005249
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(diethylamino)phenyl]methylidene}-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N)CC

STL005250
Synonyms: 9-(3-methoxyphenyl)-1,7-dimethyl-3-(3-methylbutyl)-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)CCC(C)C

STL005251
Synonyms: 2-hydroxy-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium
Smiles: COc1ccc(cc1)C1(O)CN2C(=[N+]1c1ccc(cc1)C)CCCCC2

STL005252
Synonyms: N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-N-(2-methylphenyl)-3-nitrobenzamide
Smiles: Cc1ccc2c(c1)nc(c(c2)CN(c1ccccc1C)C(=O)c1cccc(c1)[N+](=O)[O-])O

STL005253
Synonyms: {2-[(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/c1ccccc1OCC(=O)O

STL005254
Synonyms: 5-(3,4-dimethoxyphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1OC)C1N(c2nc3c(s2)cc(cc3)CC)C(=O)C(=C1C(=O)c1ccc(cc1)OC)O

STL005255
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(3-fluorophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)F

STL005256
Synonyms: 7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-8-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)N1CCN(CC1)c1nc2c(n1CCSc1nc3c(s1)cccc3)c(=O)[nH]c(=O)n2C

STL005257
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-methylthiophen-2-yl)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/c1sccc1C

STL005258
Synonyms: 6-(2-aminophenyl)-5-(4-tert-butylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Nc1ccccc1n1cc2c(c1c1ccc(cc1)C(C)(C)C)c(=O)n(c(=O)n2C)C

STL005259
Synonyms: 9-(3,4-dimethylphenyl)-3-(4-fluorobenzyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)Cn1c(=O)c2n3CC(C)CN(c3nc2n(c1=O)C)c1ccc(c(c1)C)C

STL005260
Synonyms: 9-(3-methoxyphenyl)-1-methyl-3-(3-methylbutyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cccc(c1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STL005261
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CC(c1c(nnn1c1nonc1N)C(=O)N/N=C/C=C/c1ccccc1)C

STL005262
Synonyms: 4-{(Z)-[2-(4-chloro-3-nitrophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenylethylcarbonate
Smiles: CCOC(=O)Oc1ccc(cc1)/C=C/1\N=C(OC1=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STL005265
Synonyms: 9a-[(E)-2-(2-methoxynaphthalen-1-yl)ethenyl]-9,9-dimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: COc1ccc2c(c1/C=C/C13NC(=O)CN1c1c(C3(C)C)cccc1)cccc2

STL005266
Synonyms: 5-[(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-tetrahydropyrimidin-4-olate
Smiles: COc1ccc(cc1C[NH+]1CCCCC1c1cccnc1)C(c1c(O)[nH]c(=S)[nH]c1=O)c1c([O-])[nH]c(=S)[nH]c1=O

STL005267
Synonyms: 6-benzyl-5-(4-tert-butylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Cn1c(=O)c2c(c3ccc(cc3)C(C)(C)C)n(cc2n(c1=O)C)Cc1ccccc1

STL005268
Synonyms: 10a-{(E)-2-[2-(hexyloxy)phenyl]ethenyl}-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: CCCCCCOc1ccccc1/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1

STL005269
Synonyms: 7-(1,3-benzodioxol-5-yl)-8-(2-chlorobenzyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccccc1Cn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc2c(c1)OCO2

STL005270
Synonyms: 1,3-dimethyl-8-(4-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Cc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)C

STL005271
Synonyms: 4-{[(E)-(4-methoxyphenyl)methylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1)/C=N/n1c(S)nnc1c1cccc(c1)C

STL005272
Synonyms: 9,9-dimethyl-9a-[(E)-2-(4-propoxyphenyl)ethenyl]-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: CCCOc1ccc(cc1)/C=C/C12NC(=O)CN1c1c(C2(C)C)cccc1

STL005273
Synonyms: 7-(4-chlorophenyl)-10-(4-hydroxy-3-methoxyphenyl)-3,4a,5,5a,8a,9,9a,10-octahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindole-2,6,8(7H)-trione
Smiles: COc1cc(ccc1O)C1C2C(Sc3c1sc(=O)[nH]3)C1CC2C2C1C(=O)N(C2=O)c1ccc(cc1)Cl

STL005275
Synonyms: 5-(2,4-dichlorophenyl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-{[3-methyl-4-(propan-2-yloxy)phenyl]carbonyl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: CN(CCN1C(=O)C(=C(C1c1ccc(cc1Cl)Cl)C(=O)c1ccc(c(c1)C)OC(C)C)O)C

STL005276
Synonyms: tert-butyl[(1S)-2-(1H-indol-3-yl)-1-(5-{[(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)ethyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)SCc1c(C)[nH]c(=O)[nH]c1=O)Cc1c[nH]c2c1cccc2

STL005277
Synonyms: 2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(4-methylphenyl)ethanone
Smiles: CCc1nc(SCC(=O)c2ccc(cc2)C)c2c(n1)c1ccccc1o2

STL005278
Synonyms: 10a-{(E)-2-[3-(benzyloxy)phenyl]ethenyl}-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: O=C1CCN2C(N1)(/C=C/c1cccc(c1)OCc1ccccc1)C(C)(C)c1c2cccc1

STL005280
Synonyms: 2'-[4-(difluoromethoxy)phenyl]-1-propyl-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: CCCN1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc(cc1)OC(F)F

STL005281
Synonyms: 3-{2-(4-fluorophenyl)-4-hydroxy-5-oxo-3-[(2E)-3-phenylprop-2-enoyl]-2,5-dihydro-1H-pyrrol-1-yl}benzoicacid
Smiles: Fc1ccc(cc1)C1N(c2cccc(c2)C(=O)O)C(=O)C(=C1C(=O)/C=C/c1ccccc1)O

STL005282
Synonyms: 7-(2-chlorobenzyl)-3-methyl-8-(4-methylpiperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCN(CC1)c1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C

STL005283
Synonyms: 1,1'-[1-(4-bromophenyl)-8-methyl-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-diyl]diethanone
Smiles: Brc1ccc(cc1)N1N=C(SC21SC(=C(N2c1ccccc1)C)C(=O)C)C(=O)C

STL005285
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-{(E)-[4-(propan-2-yl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)C(C)C)C