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STK547740
Synonyms: 2-[(4-amino-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc(N)c2c(n1)sc1c2CCC(C1)C

STK547741
Synonyms: 4-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-6,6-dimethyl-2-phenyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(SCc3ccc4c(c3)OCO4)nc(nc1s2)c1ccccc1

STK547742
Synonyms: 1-(4-fluorophenyl)-3-hydroxy-5-(2-nitrophenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)c1ccccc1)O

STK547745
Synonyms: diphenylmethyl(6aS,6bR,9aS,10R)-8-[2-(methoxycarbonyl)phenyl]-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)OC(c1ccccc1)c1ccccc1

STK547747
Synonyms: N-(3,5-dimethylphenyl)-10-methyl-11-(3-nitrophenyl)-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1cc(cc(c1)C)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccc(c1)[N+](=O)[O-])C)c1ccccc1

STK547748
Synonyms: 4-[(4-bromophenyl)carbonyl]-3-hydroxy-5-(4-nitrophenyl)-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: C=CCN1C(c2ccc(cc2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccc(cc1)Br

STK547750
Synonyms: 1-[1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-3-(3-chlorophenyl)urea
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)Nc1cccc(c1)Cl

STK547751
Synonyms: N-(3-chloro-4-methoxyphenyl)-11-(4-ethoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(c(c1)Cl)OC)nc1c2cccc1

STK547752
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-cyclohexylmethylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccccc1)c1nonc1N)N/N=C/C1CCCCC1

STK547753
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-chlorophenyl)carbonyl]-8-(phenylcarbonyl)-2-[2-(trifluoromethyl)phenyl]-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)C(=O)c1ccccc1

STK547754
Synonyms: ethyl2-[({[3-cyano-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc(cc(c2C#N)C(F)(F)F)c2cccs2)sc2c1CCCC2

STK547755
Synonyms: 2-{[3-cyclohexyl-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CC(OC3)C(C)C

STK547756
Synonyms: N-{1-(3-butoxypropyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}-4-methylbenzenesulfonamide
Smiles: CCCCOCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)C)S(=O)(=O)c1ccc(cc1)C

STK547757
Synonyms: (4Z)-2-(2-chloro-5-nitrophenyl)-4-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)c1cc(ccc1Cl)[N+](=O)[O-]

STK547758
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(morpholin-4-ylmethyl)-N'-{(E)-[4-(propan-2-yl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/c1ccc(cc1)C(C)C

STK547759
Synonyms: 3-bromo-2-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2H-pyran-5-carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)NC1CC(C)(C)NC(C1)(C)C

STK547761
Synonyms: methyl3-{[3-(4-benzylpiperidin-1-yl)propanoyl]amino}-5-chloro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)Cc1ccccc1)cc(cc2)Cl

STK547762
Synonyms: 6-chloro-N-[(9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl]pyridine-3-carboxamide
Smiles: S=C(NC(=O)c1ccc(nc1)Cl)Nc1ccc2c(c1)C(=O)c1c(C2=O)cccc1

STK547763
Synonyms: 2-{(5Z)-5-[4-(octyloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoicacid
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)CC

STK547764
Synonyms: (8S,8aR,11aS)-10-(3-chlorophenyl)-N-(4-chlorophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)Cl)cccc3

STK547765
Synonyms: (6aS,6bR,9aS,10R)-10-(1H-benzotriazol-1-ylcarbonyl)-8-(4-chlorophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)n1nnc2c1cccc2

STK547766
Synonyms: (3E)-3-benzylidene-1-(4-propoxyphenyl)pyrrolidine-2,5-dione
Smiles: CCCOc1ccc(cc1)N1C(=O)C/C(=C\c2ccccc2)/C1=O

STK547768
Synonyms: ethyl2-imino-1-(4-methoxybenzyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Smiles: CCOC(=O)c1cc2c(n(c1=N)Cc1ccc(cc1)OC)nc1n(c2=O)cccc1

STK547769
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-{4-[(2-chlorobenzyl)oxy]phenyl}ethylidene]-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)/c1ccc(cc1)OCc1ccccc1Cl

STK547770
Synonyms: 4-(decyloxy)-N-[(E)-{4-[(4-methyl-3,6-dihydro-2H-pyran-3-yl)oxy]phenyl}methylidene]aniline
Smiles: CCCCCCCCCCOc1ccc(cc1)/N=C/c1ccc(cc1)OC1COCC=C1C

STK547772
Synonyms: (3-amino-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridin-2-yl)(4-methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)c1sc2c(c1N)cc1c(n2)CCCCC1

STK547773
Synonyms: 2-[(2-methoxyphenyl)amino]-2-oxoethylN'-cyano-N-propan-2-ylcarbamimidothioate
Smiles: N#C/N=C(\NC(C)C)/SCC(=O)Nc1ccccc1OC

STK547774
Synonyms: 4-(benzylsulfanyl)-6,6-dimethyl-2-phenyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(SCc3ccccc3)nc(nc1s2)c1ccccc1

STK547775
Synonyms: ethyl8-(2,5-dimethylphenyl)-1-(3-nitrophenyl)-6-phenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7-diene-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)CCC(=NN2c1ccccc1)c1cc(C)ccc1C)c1cccc(c1)[N+](=O)[O-]

STK547777
Synonyms: 2-imino-N-(2-methoxyethyl)-5-oxo-1-(prop-2-en-1-yl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: C=CCn1c(=N)c(cc2c1nc1ccccn1c2=O)C(=O)NCCOC

STK547778
Synonyms: 2-(4-chlorophenyl)-3-{6-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]hexyl}quinazolin-4(3H)-one
Smiles: C=CCc1ccc(c(c1)OC)OCCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK547779
Synonyms: methyl5-chloro-3-{[3-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)propanoyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC3(CC1)OCCO3)cc(cc2)Cl

STK547780
Synonyms: N'~1~-[(3E)-1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-N'~7~-[(3Z)-1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]heptanedihydrazide
Smiles: CCCCN1C(=O)/C(=N/NC(=O)CCCCCC(=O)N/N=C\2/c3ccccc3N(C2=O)CCCC)/c2c1cccc2

STK547781
Synonyms: 4-[(8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-9,11-dioxo-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-10(11H)-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=Cc2c1cccc2

STK547782
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-N'-{(1E)-1-[3-(2H-tetrazol-2-yl)phenyl]ethylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C(/c1cccc(c1)n1nncn1)\C

STK547783
Synonyms: 2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dimethoxyphenyl)acetamide
Smiles: COc1ccc(cc1OC)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl

STK547784
Synonyms: 2-[(2-ethyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(4-methylphenyl)acetamide
Smiles: CCc1nc(SCC(=O)Nc2ccc(cc2)C)c2c(n1)sc1c2CC(OC1)(C)C

STK547785
Synonyms: [1-{bis[2-(hydroxy-kappaO)ethyl]amino-kappaN}-3-(2-methylphenoxy)propan-2-olato(3-)-kappaO]boron
Smiles: Cc1ccccc1OCC1C[N+]23[B-](O1)(OCC3)OCC2

STK547786
Synonyms: (2'R,3'R)-2'-(4-nitrophenyl)-3'-(phenylcarbonyl)-2',3'-dihydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-1,3-dione
Smiles: O=C([C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1ccc(cc1)[N+](=O)[O-])C(=O)c1c(C2=O)cccc1)cccc3)c1ccccc1

STK547788
Synonyms: 3-[(Z)-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-2-(dimethylamino)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: COc1cc(CCN2C(=S)S/C(=C\c3c(nc4n(c3=O)cccc4C)N(C)C)/C2=O)ccc1OC

STK547789
Synonyms: [(4-bromophenyl)sulfonyl][1,4-dioxo-3-(1-pentyl-1H-imidazol-3-ium-3-yl)-1,4-dihydronaphthalen-2-yl]azanide
Smiles: CCCCCn1cc[n+](c1)C1=C([N-]S(=O)(=O)c2ccc(cc2)Br)C(=O)c2c(C1=O)cccc2

STK547790
Synonyms: 2-[(2-butyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(2-chlorophenyl)acetamide
Smiles: CCCCc1nc(SCC(=O)Nc2ccccc2Cl)c2c(n1)sc1c2CC(OC1)(C)C

STK547791
Synonyms: ethyl4-{3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-5-(3-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)c1ccc(cc1)OC)O

STK547792
Synonyms: 4-(naphthalen-1-yl)-5-[5-(thiophen-3-yl)-1H-pyrazol-3-yl]-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1c1cccc2c1cccc2)c1n[nH]c(c1)c1cscc1

STK547793
Synonyms: 2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)N)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547794
Synonyms: [3-amino-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl](3,4-dimethoxyphenyl)methanone
Smiles: COc1cc(ccc1OC)C(=O)c1sc2c(c1N)c(cc(n2)c1ccccc1)C(F)(F)F

STK547795
Synonyms: ethyl1-benzyl-2-{[(2-chlorophenyl)carbonyl]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2Cl)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK547797
Synonyms: ethyl(1R,2R,3S,3aS)-1-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(4-bromophenyl)-3-cyano-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Smiles: CCOC(=O)[C@@]1(C#N)[C@@H](c2ccc(cc2)Br)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccc(c(c1)Br)OC

STK547798
Synonyms: ethyl6-bromo-2-[(diethylamino)methyl]-5-hydroxy-1-phenyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c2cc(O)c(cc2n(c1CN(CC)CC)c1ccccc1)Br

STK547799
Synonyms: ethyl4-[4-oxo-11-(2-phenylethyl)-4,11-dihydro-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-3-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2CCc1ccccc1

STK547800
Synonyms: 2-[(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Smiles: CCc1nc(SCC(=O)Nc2ccc(cc2)OC)c2c(n1)sc1c2CCCC1

STK547801
Synonyms: 1-methoxypropan-2-yl2-amino-1-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1)C

STK547802
Synonyms: 1,1'-ethyne-1,2-diylbis[4-(prop-1-yn-1-yl)benzene]
Smiles: CC#Cc1ccc(cc1)C#Cc1ccc(cc1)C#CC

STK547803
Synonyms: 4-[(E)-2-(1-butyl-1H-benzimidazol-2-yl)ethenyl]-N,N-dimethylaniline
Smiles: CCCCn1c(/C=C/c2ccc(cc2)N(C)C)nc2c1cccc2

STK547804
Synonyms: (5Z)-3-(3-bromophenyl)-5-[4-(octyloxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1cccc(c1)Br

STK547805
Synonyms: 3-fluorobenzylN'-cyano-N-(3-fluorophenyl)carbamimidothioate
Smiles: N#C/N=C(/Nc1cccc(c1)F)\SCc1cccc(c1)F

STK547806
Synonyms: 2-{[3-cyano-4-(4-methoxyphenyl)-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Smiles: COc1ccc(cc1)c1cc(nc(c1C#N)SCC(=O)Nc1ccc(cc1)F)c1cccs1

STK547807
Synonyms: 2-[(3-methylbutyl)sulfanyl]-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCn1c(SCCC(C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547808
Synonyms: 8-{2-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]hydrazinyl}-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: S=C1N(C)C(=O)C(=CNNc2nc3c(n2C)c(=O)n(c(=O)n3C)C)C(=O)N1C

STK547809
Synonyms: 4-amino-N'-[(E)-{3-bromo-4-[(4-chlorobenzyl)oxy]-5-ethoxyphenyl}methylidene]-1,2,5-oxadiazole-3-carbohydrazonamide
Smiles: CCOc1cc(/C=N/N=C(\c2nonc2N)/N)cc(c1OCc1ccc(cc1)Cl)Br

STK547810
Synonyms: 3-[3-(2-bromo-4,6-dimethylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)cc(cc1Br)C

STK547811
Synonyms: 2-amino-N-hexyl-1-[2-(4-methoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(cc1)OC

STK547812
Synonyms: 5-(2-chlorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1-(2-phenylethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccccc1Cl)CCc1ccccc1)c1ccccc1

STK547814
Synonyms: 3-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(2-hydroxyethyl)piperazin-1-yl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)CCO)/C1=O

STK547815
Synonyms: methyl4-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSC1=NCCS1)c1nonc1N

STK547816
Synonyms: 2-(4-methoxyphenyl)-3-[2-(4-nitrophenoxy)ethyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1)[N+](=O)[O-]

STK547818
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-N'-[(E)-naphthalen-1-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1cccc2c1cccc2

STK547819
Synonyms: diphenylmethyl(6aS,6bR,9aS,10R)-7,9-dioxo-8-[2-(trifluoromethyl)phenyl]-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: O=C([C@@H]1N2c3ccccc3C=C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)OC(c1ccccc1)c1ccccc1

STK547820
Synonyms: 11-(3,4-dimethoxyphenyl)-3-(3,5-dimethylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1cc(ccc1OC)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK547821
Synonyms: 3-[2-(2-ethylphenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: CCc1ccccc1OCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK547822
Synonyms: 2-(4-methoxyphenyl)-3-[3-(2,3,6-trimethylphenoxy)propyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)ccc(c1C)C

STK547823
Synonyms: N'~1~-[(3Z)-5-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-N'~6~-[(3Z)-6-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hexanedihydrazide
Smiles: COc1ccc2c(c1)NC(=O)/C/2=N\NC(=O)CCCCC(=O)N/N=C/1\C(=O)Nc2c1cc(OC)cc2

STK547824
Synonyms: (5E)-2-[4-(3-methylphenyl)piperazin-1-yl]-5-{2-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazol-4(5H)-one
Smiles: Cc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccccc2OCc2ccc(cc2)[N+](=O)[O-])/S1

STK547825
Synonyms: N-(3-chloro-4-methoxyphenyl)-11-(3,4-dimethoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(c(c1)OC)OC)C)c1ccccc1

STK547826
Synonyms: N-{2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-2-phenylacetamide
Smiles: N#Cc1c(sc(c1CC)C)NC(C(F)(F)F)(C(F)(F)F)NC(=O)Cc1ccccc1

STK547828
Synonyms: N,N-diethyl-2-[4-(4-{[4-methoxy-3-(piperidin-1-ylcarbonyl)phenyl]amino}phthalazin-1-yl)phenoxy]acetamide
Smiles: CCN(C(=O)COc1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc(c(c1)C(=O)N1CCCCC1)OC)CC

STK547829
Synonyms: 4-[(2E)-2-benzylidenehydrazinyl]-2-(pyridin-3-yl)quinazoline
Smiles: c1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1cccnc1

STK547830
Synonyms: N-(2-methoxyphenyl)-2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2ccccc2OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547832
Synonyms: 2-{[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCC3

STK547833
Synonyms: (8S,8aR,11aS)-10-(2,4-dimethylphenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3

STK547834
Synonyms: 2-(benzylamino)-2-oxoethylN'-cyano-N-prop-2-en-1-ylcarbamimidothioate
Smiles: C=CCN/C(=N/C#N)/SCC(=O)NCc1ccccc1

STK547838
Synonyms: 3-(3,4-dichlorophenyl)-11-(4-methylphenyl)-10-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Cc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(c(c2)Cl)Cl)Nc2c(N1C(=O)c1ccccc1)cccc2

STK547840
Synonyms: N-(diphenylmethyl)-2-{[3-(3-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCCC3

STK547841
Synonyms: [3-(4-{[(2-chlorophenyl)carbonyl]amino}pyridinium-1-yl)quinoxalin-2-yl][(4-chlorophenyl)sulfonyl]azanide
Smiles: Clc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)NC(=O)c1ccccc1Cl

STK547842
Synonyms: 2-[(5-ethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]-N-(4-methylphenyl)acetamide
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)C)nn2)CCCC3

STK547843
Synonyms: 2-[(5-phenyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]-1-(piperidin-1-yl)ethanone
Smiles: O=C(N1CCCCC1)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1

STK547844
Synonyms: 3-{[benzyl(ethyl)amino]methyl}-6-ethyl-2-methylquinolin-4-ol
Smiles: CCN(Cc1c(C)nc2c(c1O)cc(cc2)CC)Cc1ccccc1

STK547845
Synonyms: 2-methoxyethyl2-amino-1-(4-hydroxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)O

STK547846
Synonyms: ethyl5-methoxy-3-{[3-methyl-4-(3-methylphenyl)butanoyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CC(Cc1cccc(c1)C)C)cc(cc2)OC

STK547849
Synonyms: methyl4-[3-(4-tert-butylphenyl)-1-oxo-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
Smiles: CCC(=O)N1c2ccccc2NC2=C(C1c1ccc(cc1)C(=O)OC)C(=O)CC(C2)c1ccc(cc1)C(C)(C)C

STK547850
Synonyms: 2-(3-bromo-2,8-dimethyl-4-oxoquinolin-1(4H)-yl)-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)Cn1c(C)c(Br)c(=O)c2c1c(C)ccc2

STK547851
Synonyms: 2-(4-chlorophenyl)-3-[3-(2,4,6-trimethylphenoxy)propyl]quinazolin-4(3H)-one
Smiles: Cc1cc(C)c(c(c1)C)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK547852
Synonyms: ethyl4-[(4-fluorophenyl)amino]-2-methylquinoline-6-carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)c(Nc1ccc(cc1)F)cc(n2)C

STK547853
Synonyms: 3-{[2-(3-methylphenyl)quinazolin-4-yl]amino}benzoicacid
Smiles: Cc1cccc(c1)c1nc(Nc2cccc(c2)C(=O)O)c2c(n1)cccc2

STK547855
Synonyms: 2-[(4-amino-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-phenylacetamide
Smiles: CC1CCc2c(C1)sc1c2c(N)nc(n1)SCC(=O)Nc1ccccc1

STK547856
Synonyms: octyl3-(6-methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl)propanoate
Smiles: CCCCCCCCOC(=O)CCc1c(C)[nH]c(=S)[nH]c1=O

STK547857
Synonyms: N-(4-bromophenyl)-2-[(6,6-dimethyl-2-phenyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK547858
Synonyms: ethyl4-{2-(3-fluorophenyl)-4-hydroxy-3-[(4-methoxyphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1cccc(c1)F)C(=O)c1ccc(cc1)OC)O

STK547860
Synonyms: (4Z)-4-(4-ethoxy-3,5-diiodobenzylidene)-2-(furan-2-yl)-1,3-oxazol-5(4H)-one
Smiles: CCOc1c(I)cc(cc1I)/C=C/1\N=C(OC1=O)c1ccco1

STK547861
Synonyms: propan-2-yl2-amino-1-(tetrahydrofuran-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CC1CCCO1)C

STK547862
Synonyms: 2-amino-1-(3,5-dichlorophenyl)-N-(1-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Clc1cc(Cl)cc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NC(c1ccccc1)C

STK547863
Synonyms: 4-acetyl-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-5-(2-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccccc1[N+](=O)[O-])CCCN1CCOCC1

STK547864
Synonyms: (6aS,6bR,9aS,10R)-10-[(3-bromo-4-methoxyphenyl)carbonyl]-8-(4-fluorophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)F)C=Cc1c2cccc1

STK547865
Synonyms: 2-[(6-iodo-4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2ccc(cc2c(=O)n1c1ccccc1)I

STK547866
Synonyms: 2-amino-1-(3,5-dimethylphenyl)-N-(1-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1cc(C)cc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NC(c1ccccc1)C

STK547867
Synonyms: 1-benzyl-2-imino-10-methyl-5-oxo-N-(tetrahydrofuran-2-ylmethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: O=C(c1cc2c(n(c1=N)Cc1ccccc1)nc1n(c2=O)cccc1C)NCC1CCCO1

STK547868
Synonyms: (2Z)-3-(5-methylfuran-2-yl)-2-{[(4-methylphenyl)carbonyl]amino}prop-2-enoicacid
Smiles: Cc1ccc(cc1)C(=O)N/C(=C\c1ccc(o1)C)/C(=O)O

STK547869
Synonyms: N-[1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-2-methylbenzamide
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccccc1C

STK547870
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-chlorophenyl)carbonyl]-2-(3-fluorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=CC(=C1)C(=O)c1ccccc1

STK547871
Synonyms: 2-{[3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(4-methoxybenzyl)acetamide
Smiles: COc1ccc(cc1)CNC(=O)CSc1nc(cc(c1C#N)c1cccs1)c1ccc(cc1)OC

STK547872
Synonyms: methyl(1R,2R,3R,3aS)-3-cyano-2-(4-nitrophenyl)-1-(phenylcarbonyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Smiles: COC(=O)[C@]1(C#N)[C@@H](c2ccc(cc2)[N+](=O)[O-])[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccccc1

STK547873
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazole
Smiles: Cc1ccc(cc1)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK547874
Synonyms: 3-(3,5-dimethylphenyl)-11-(4-ethoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)c1cc(C)cc(c1)C

STK547875
Synonyms: 2-(2-amino-3-cyano-1H-pyrrolo[2,3-b]quinoxalin-1-yl)ethyl3-nitrobenzoate
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)CCOC(=O)c1cccc(c1)[N+](=O)[O-]

STK547876
Synonyms: (3aR,4S,9aR,9bS)-2-(4-acetylphenyl)-4-[(4-chlorophenyl)carbonyl]-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)C(=O)C)C(=O)c1ccccc1

STK547877
Synonyms: butyl2-amino-1-(3,5-dichlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(Cl)cc(c1)Cl

STK547878
Synonyms: N-(2-{(2Z)-2-[1-(3,4-dichlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-3-phenylpropanamide(non-preferredname)
Smiles: O=C(N/N=C(\c1ccc(c(c1)Cl)Cl)/C)CNC(=O)CCc1ccccc1

STK547879
Synonyms: 3-(naphthalen-2-ylamino)-1-(4-propoxyphenyl)pyrrolidine-2,5-dione
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)Nc1ccc2c(c1)cccc2

STK547880
Synonyms: 3-(3-fluorophenyl)-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: Fc1cccc(c1)n1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK547882
Synonyms: ethyl1-(3-{[(4-bromophenyl)sulfonyl]amino}-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C1=C(NS(=O)(=O)c2ccc(cc2)Br)C(=O)c2c(C1=O)cccc2

STK547884
Synonyms: 4-acetyl-3-hydroxy-5-(4-methoxyphenyl)-1-[3-(morpholin-4-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)C)O

STK547886
Synonyms: N-[1-(1H-benzimidazol-2-yl)ethyl]-3,5-dinitrobenzamide
Smiles: CC(c1nc2c([nH]1)cccc2)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

STK547887
Synonyms: 2,7,8-trimethyl-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methyl]quinolin-4-ol
Smiles: Cc1nc2c(C)c(C)ccc2c(c1CN1CC2(CC1CC(C2)(C)C)C)O

STK547889
Synonyms: 4-(1-methyl-1H-indol-3-yl)-3-nitro-4-phenylbutan-2-one
Smiles: Cn1cc(c2c1cccc2)C(C(C(=O)C)[N+](=O)[O-])c1ccccc1

STK547890
Synonyms: 4-[(4-chlorophenyl)carbonyl]-3-hydroxy-1-(4-methoxyphenyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)N1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK547891
Synonyms: (8S,8aR,11aS)-8-[(4-methoxyphenyl)carbonyl]-10-(naphthalen-1-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc2c1cccc2)cccc3

STK547892
Synonyms: 5-(2-chlorophenyl)-1,3-diphenyl-4,5-dihydro-1H-pyrazole
Smiles: Clc1ccccc1C1CC(=NN1c1ccccc1)c1ccccc1

STK547893
Synonyms: 2-(benzylsulfanyl)-5-[(3-fluorobenzyl)sulfanyl]-1,3,4-thiadiazole
Smiles: Fc1cccc(c1)CSc1nnc(s1)SCc1ccccc1

STK547894
Synonyms: (2E)-2-[4-(propan-2-yloxy)benzylidene]hydrazinecarbothioamide
Smiles: CC(Oc1ccc(cc1)/C=N/NC(=S)N)C

STK547895
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-N'-[(E)-(4-propoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK547896
Synonyms: 1-{(Z)-[(2-phenylethyl)imino]methyl}naphthalen-2-ylbenzenesulfonate
Smiles: O=S(=O)(c1ccccc1)Oc1ccc2c(c1/C=N\CCc1ccccc1)cccc2

STK547897
Synonyms: 3-amino-N-(4-chlorophenyl)-4-(4-methoxyphenyl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1ccc(cc1)c1cc(nc2c1c(N)c(s2)C(=O)Nc1ccc(cc1)Cl)c1cccs1

STK547898
Synonyms: 8-chloro-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-5H-pyrimido[5,4-b]indole
Smiles: Clc1ccc2c(c1)c1ncnc(c1[nH]2)N1CC2(CC1CC(C2)(C)C)C

STK547899
Synonyms: 2-{[3-cyano-4,6-di(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(1-phenylethyl)acetamide
Smiles: N#Cc1c(SCC(=O)NC(c2ccccc2)C)nc(cc1c1cccs1)c1cccs1

STK547900
Synonyms: 2-{[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: COc1cccc(c1)n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547901
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-chlorophenyl)carbonyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)C(=O)c1ccccc1

STK547902
Synonyms: 2-amino-1-(2-chlorobenzyl)-N-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1Cl

STK547903
Synonyms: 2-[(2-ethyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-phenylethanone
Smiles: CCc1nc(SCC(=O)c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C

STK547904
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(2-fluorobenzyl)oxy]phenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Fc1ccccc1COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK547905
Synonyms: 2-amino-N-(2-methoxyphenyl)-1-(4-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccccc1NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C

STK547906
Synonyms: 2-(4-methoxyphenyl)-3-[3-(naphthalen-2-yloxy)propyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc2c(c1)cccc2

STK547907
Synonyms: 2-amino-N-hexyl-1-(3,4,5-trimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(OC)c(c(c1)OC)OC

STK547908
Synonyms: 2-(diethylamino)-3-[(Z)-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCN(c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC)CC

STK547909
Synonyms: N,N-diethyl-2-{[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)OC)CCCCC3)CC

STK547910
Synonyms: 5-(4-chlorophenyl)-3-hydroxy-4-[(4-nitrophenyl)carbonyl]-1-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C1N(c2ccccc2)C(=O)C(=C1C(=O)c1ccc(cc1)[N+](=O)[O-])O

STK547912
Synonyms: 2-[(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-phenylacetamide
Smiles: CCc1nc(SCC(=O)Nc2ccccc2)c2c(n1)sc1c2CCCC1

STK547913
Synonyms: N'-{(E)-[1-(4-ethoxyphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}pentanehydrazide
Smiles: CCCCC(=O)NN/C=C/1\C(=O)NC(=S)N(C1=O)c1ccc(cc1)OCC

STK547914
Synonyms: 3-[2-(2-chlorophenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccccc1Cl

STK547915
Synonyms: N-benzyl-4-(4-tert-butylphenoxy)-6-methylpyrimidin-2-amine
Smiles: Cc1cc(Oc2ccc(cc2)C(C)(C)C)nc(n1)NCc1ccccc1

STK547916
Synonyms: 2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(naphthalen-1-yl)ethylidene]acetohydrazide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)N/N=C(/c1cccc2c1cccc2)\C

STK547917
Synonyms: 2-{[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1cc(ccc1Cl)C(F)(F)F)c1ccc2c(c1)OCO2

STK547918
Synonyms: 5-(4-bromophenyl)-4-[(4-chlorophenyl)carbonyl]-3-hydroxy-1-(pyridin-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)Br)c1ccccn1

STK547919
Synonyms: 4-acetyl-1-hexadecyl-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCCCCCCCCCCCCCN1C(=O)C(=C(C1c1ccc(c(c1)OC)O)C(=O)C)O

STK547920
Synonyms: (8S,8aR,11aS)-10-(4-fluorophenyl)-8-[(3-nitrophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2

STK547922
Synonyms: ethyl6-bromo-4-[(2,5-dimethoxyphenyl)amino]quinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1cc(OC)ccc1OC)cc(cc2)Br

STK547923
Synonyms: N,N-diethyl-2-{[8-(2-methylprop-2-en-1-yl)-7-oxo-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCc1c3cccc1)CC

STK547924
Synonyms: 3-[5-(4-nitrophenyl)thiophen-2-yl]-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(s1)c1ccc(cc1)[N+](=O)[O-]

STK547927
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{5-chloro-2-[(2,6-dichlorobenzyl)oxy]phenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N)OCc1c(Cl)cccc1Cl

STK547928
Synonyms: 2-chloro-N-(12-cyanoindolizino[2,3-b]quinoxalin-2-yl)benzamide
Smiles: N#Cc1c2cc(ccn2c2c1nc1ccccc1n2)NC(=O)c1ccccc1Cl

STK547930
Synonyms: 1-methoxypropan-2-yl2-amino-1-(1,3-benzodioxol-5-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCO2)C

STK547931
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-fluorophenyl)methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Fc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK547932
Synonyms: 8-(azepan-1-ylmethyl)-3-(2-bromophenoxy)-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: Oc1ccc2c(c1CN1CCCCCC1)oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F

STK547933
Synonyms: methyl[(2-ethyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nc(CC)nc2c1c1CC(C)(C)OCc1s2

STK547935
Synonyms: N-(2,4-dimethylphenyl)-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK547936
Synonyms: 3-(3,5-dimethylphenyl)-11-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1cccc(c1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)c1cc(C)cc(c1)C

STK547938
Synonyms: 2-(4-methoxyphenyl)-3-[3-(4-methylphenoxy)propyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1)C

STK547940
Synonyms: 5-(4-ethoxyphenyl)-2,3,3a-triphenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=O)C2C(C1=O)(c1ccccc1)C(N(O2)c1ccccc1)c1ccccc1

STK547941
Synonyms: (2Z)-[4-(4-fluorophenyl)-1,3-thiazol-2-yl](hydroxyimino)ethanenitrile
Smiles: O/N=C(\c1scc(n1)c1ccc(cc1)F)/C#N

STK547944
Synonyms: ethyl6-amino-5-cyano-4-(2-fluorophenyl)-2-(4-methoxyphenyl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(OC(=C(C1c1ccccc1F)C#N)N)c1ccc(cc1)OC

STK547945
Synonyms: 2-amino-N-butyl-1-(3-chloro-4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)OC

STK547946
Synonyms: 3-(2-chlorophenyl)-8-[(diethylamino)methyl]-7-hydroxy-4H-chromen-4-one
Smiles: CCN(Cc1c(O)ccc2c1occ(c2=O)c1ccccc1Cl)CC

STK547948
Synonyms: 3-{[benzyl(methyl)amino]methyl}-2,7,8-trimethylquinolin-4-ol
Smiles: CN(Cc1c(C)nc2c(c1O)ccc(c2C)C)Cc1ccccc1

STK547950
Synonyms: 4-fluoro-N-{1-(3-methoxypropyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzenesulfonamide
Smiles: COCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)F)S(=O)(=O)c1ccc(cc1)C

STK547951
Synonyms: 2-[(6,6-dimethyl-2-phenyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-phenylethanone
Smiles: O=C(c1ccccc1)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK547954
Synonyms: 3-hydroxy-1-(4-methoxyphenyl)-5-phenyl-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1)C(=O)c1ccccc1)O

STK547955
Synonyms: 2-amino-1-(1,3-benzodioxol-5-yl)-N-[2-(4-methoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCO2

STK547956
Synonyms: 1-(4-fluorophenyl)-3-hydroxy-4-[(4-methylphenyl)carbonyl]-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)F

STK547957
Synonyms: 2-({5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N'-[(E)-(3,4-dichlorophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccc(cc1)Cl)N/N=C/c1ccc(c(c1)Cl)Cl

STK547958
Synonyms: 1-(4-bromophenyl)-3-hydroxy-5-(4-methoxyphenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1N(c2ccc(cc2)Br)C(=O)C(=C1C(=O)c1ccccc1)O

STK547959
Synonyms: ethyl(8S,8aR)-6-amino-5,7,7-tricyano-8-{3-ethoxy-4-[2-(morpholin-4-yl)ethoxy]phenyl}-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: CCOc1cc(ccc1OCCN1CCOCC1)[C@@H]1[C@H]2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OCC

STK547960
Synonyms: 3-methyl-1-(4-methylphenyl)-4-{(E)-[(6-methylpyridin-2-yl)imino]methyl}-1H-pyrazol-5-ol
Smiles: Cc1ccc(cc1)n1nc(c(c1O)/C=N/c1cccc(n1)C)C

STK547961
Synonyms: 2-(2-cyanoethyl)-1-[(4-ethoxyphenyl)amino]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#CCCc1c(C)c(C#N)c2n(c1Nc1ccc(cc1)OCC)c1ccccc1n2

STK547962
Synonyms: 2-{[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(4-methoxy-2-methylphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2C)OC)nc(c(c1c1cccs1)C#N)N

STK547963
Synonyms: 9-(4-fluorophenyl)-2-(2,4,6-trimethylphenyl)tetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Smiles: Cc1cc(C)c(c(c1)C)N1C(=O)C2C(C1=O)N1N(C2c2ccc(cc2)F)CCC1

STK547964
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(2,4-dimethylphenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3

STK547965
Synonyms: 2-(methylsulfanyl)-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCn1c(SC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547966
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3-bromo-4-methoxyphenyl)carbonyl]-2'-[(3-nitrophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccc(c1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3

STK547967
Synonyms: (6aS,6bR,9aS,10R)-10-[(3-bromo-4-methoxyphenyl)carbonyl]-8-(2-chlorophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1Cl)C=Cc1c2cccc1

STK547968
Synonyms: N~2~-benzyl-N~4~,6-dimethylpyrimidine-2,4-diamine
Smiles: CNc1nc(NCc2ccccc2)nc(c1)C

STK547969
Synonyms: N'-[(3Z)-2-oxo-1-(prop-2-yn-1-yl)-1,2-dihydro-3H-indol-3-ylidene]pyridine-2-carbohydrazide
Smiles: C#CCN1c2ccccc2/C(=N/NC(=O)c2ccccn2)/C1=O

STK547970
Synonyms: (8S,8aR,11aS)-10-(3,5-dichlorophenyl)-8-[(3-nitrophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2

STK547971
Synonyms: 1-[3-(4-bromophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-chloroethanone
Smiles: ClCC(=O)N1N=C(CC1c1ccc(cc1)F)c1ccc(cc1)Br

STK547972
Synonyms: ethyl4-(4-oxo-2-pentylquinazolin-3(4H)-yl)benzoate
Smiles: CCCCCc1nc2ccccc2c(=O)n1c1ccc(cc1)C(=O)OCC

STK547973
Synonyms: methyl5-chloro-3-{[3-(3,5-dimethylpiperidin-1-yl)propanoyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CC(C)CC(C1)C)cc(cc2)Cl

STK547974
Synonyms: N-[1-(1-benzyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-fluorobenzamide
Smiles: CSCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)c1ccc(cc1)F

STK547975
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-bromophenyl)methylidene]-5-(morpholin-4-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/c1ccc(cc1)Br

STK547976
Synonyms: 2-imino-N-(2-methoxyethyl)-10-methyl-5-oxo-1-propyl-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: CCCn1c(=N)c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCCOC

STK547977
Synonyms: 7,8-dimethoxy-2-(2-phenoxyethyl)phthalazin-1(2H)-one
Smiles: COc1c(OC)ccc2c1c(=O)n(nc2)CCOc1ccccc1

STK547979
Synonyms: 11-(3-bromophenyl)-N-(2,4-dimethoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Br)c(nn1c1ccccc1)C

STK547980
Synonyms: methyl5-({4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-ethoxyphenoxy}methyl)furan-2-carboxylate
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc1OCc1ccc(o1)C(=O)OC

STK547981
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-N'-[(E)-pyridin-3-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccccc1)c1nonc1N)N/N=C/c1cccnc1

STK547982
Synonyms: 3-butyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCn1c(SCC(=C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547983
Synonyms: 4-[(4-chlorophenyl)carbonyl]-5-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)C1NC(=O)C(=C1C(=O)c1ccc(cc1)Cl)O

STK547984
Synonyms: 2-methylbenzylN'-cyano-N-(4-ethoxyphenyl)carbamimidothioate
Smiles: CCOc1ccc(cc1)N/C(=N\C#N)/SCc1ccccc1C

STK547985
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-methoxyphenyl}methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)cc(c1OCc1ccccc1Cl)Br

STK547986
Synonyms: 4-[(4-methyl-3,6-dihydro-2H-pyran-3-yl)oxy]-N-{(E)-[4-(nonyloxy)phenyl]methylidene}aniline
Smiles: CCCCCCCCCOc1ccc(cc1)/C=N/c1ccc(cc1)OC1COCC=C1C

STK547987
Synonyms: N-(4-chlorophenyl)-2-(pyridin-3-yl)quinazolin-4-amine
Smiles: Clc1ccc(cc1)Nc1nc(nc2c1cccc2)c1cccnc1

STK547988
Synonyms: ethyl4-[{2-[(4-chlorophenoxy)acetyl]hydrazinyl}(oxo)acetyl]piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)C(=O)NNC(=O)COc1ccc(cc1)Cl

STK547989
Synonyms: 3-(4-bromophenyl)-5-(4-chloro-3-fluorophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Brc1ccc(cc1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)c1ccc(c(c1)F)Cl

STK547990
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)ccc1OC

STK547993
Synonyms: N'~1~-[(3E)-1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-N'~5~-[(3Z)-1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]pentanedihydrazide
Smiles: CCCCN1C(=O)/C(=N/NC(=O)CCCC(=O)N/N=C\2/c3ccccc3N(C2=O)CCCC)/c2c1cccc2

STK547994
Synonyms: 2-(4-methoxyphenyl)-3-[3-(3-methylphenoxy)propyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cccc(c1)C

STK547995
Synonyms: 2-{[3-cyano-6-phenyl-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(propan-2-yl)acetamide
Smiles: N#Cc1c(SCC(=O)NC(C)C)nc(cc1c1cccs1)c1ccccc1

STK547997
Synonyms: 4-chloro-N-[5-(2-methoxyethyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: COCCc1nnc(s1)NC(=O)c1ccc(cc1)Cl

STK547998
Synonyms: 3-amino-N-(4-chlorobenzyl)-6-ethyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)NCc1ccc(cc1)Cl

STK548000
Synonyms: (8S,8aR,11aS)-10-(2-methoxy-5-nitrophenyl)-8-[(3-nitrophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1C2c2ccccc2C=C1)C(=O)c1cccc(c1)[N+](=O)[O-])[N+](=O)[O-]

STK548001
Synonyms: 2-(4-bromophenyl)-2-oxoethyl4-(4-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate
Smiles: Brc1ccc(cc1)C(=O)COC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)[N+](=O)[O-]

STK548002
Synonyms: 3-amino-4-(4-chlorophenyl)-N-(propan-2-yl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: CC(NC(=O)c1sc2c(c1N)c(cc(n2)c1cccs1)c1ccc(cc1)Cl)C

STK548003
Synonyms: 3-methyl-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)Cc1cccc3c1cccc3)c1ccccc1n2

STK548006
Synonyms: (phenylsulfonyl)(3-{4-[(thiophen-2-ylcarbonyl)amino]pyridinium-1-yl}quinoxalin-2-yl)azanide
Smiles: O=C(c1cccs1)Nc1cc[n+](cc1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1

STK548009
Synonyms: 6-bromo-2-methyl-3-(piperidin-1-ylmethyl)quinolin-4(1H)-one
Smiles: Cc1[nH]c2ccc(cc2c(=O)c1CN1CCCCC1)Br

STK548010
Synonyms: (6aS,6bR,9aS,10R)-8-(1,3-benzodioxol-5-yl)-10-[(3-bromo-4-methoxyphenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc3c(c1)OCO3)C=Cc1c2cccc1

STK548011
Synonyms: 5-(3-fluorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1-(2-phenylethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1cccc(c1)C1C(=C(C(=O)N1CCc1ccccc1)O)C(=O)c1ccccc1

STK548012
Synonyms: 3-methyl-2-octyl-1-(phenylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1Nc1ccccc1)c1ccccc1n2

STK548013
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-{[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nc(cc1C(F)(F)F)c1ccccc1

STK548014
Synonyms: 1-[(4-tert-butylbenzyl)oxy]-3-(4-methylphenyl)quinoxalin-2(1H)-one4-oxide
Smiles: Cc1ccc(cc1)c1c(=O)n(OCc2ccc(cc2)C(C)(C)C)c2c([n+]1[O-])cccc2

STK548016
Synonyms: 4-fluorobenzylN'-cyano-N-(2-fluorophenyl)carbamimidothioate
Smiles: N#C/N=C(/Nc1ccccc1F)\SCc1ccc(cc1)F

STK548017
Synonyms: N,N'-bis[(E)-1,3-benzodioxol-5-ylmethylidene]propane-1,2-diamine
Smiles: CC(/N=C/c1ccc2c(c1)OCO2)C/N=C/c1ccc2c(c1)OCO2

STK548018
Synonyms: prop-2-en-1-yl2-amino-1-(2-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1OC

STK548019
Synonyms: prop-2-en-1-yl2-amino-1-(3-chlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)Cl

STK548020
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(3-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])cccc3

STK548021
Synonyms: 4-ethyl-2,6-bis(furan-2-ylmethyl)-9,10-diphenylhexahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetrone
Smiles: CCC12C3C(=O)N(C(=O)C3C(C3C1C(=O)N(C3=O)Cc1ccco1)C(=C2c1ccccc1)c1ccccc1)Cc1ccco1

STK548022
Synonyms: 6-bromo-4-(2-chlorophenyl)-3-(piperidin-1-yl)-3,4-dihydroquinolin-2(1H)-one
Smiles: Brc1ccc2c(c1)C(C(C(=O)N2)N1CCCCC1)c1ccccc1Cl

STK548023
Synonyms: 2-{[4,5-bis(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-1H-indol-3-ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C)N/N=C/c1c[nH]c2c1cccc2

STK548024
Synonyms: 2-(2-fluorophenyl)-N-(furan-2-ylmethyl)quinazolin-4-amine
Smiles: Fc1ccccc1c1nc(NCc2ccco2)c2c(n1)cccc2

STK548025
Synonyms: ethyl1-{2-[(3-tert-butyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenoxazin-7-yl)amino]ethyl}piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CCNc1cc2oc3cc(ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1)C(C)(C)C

STK548026
Synonyms: methyl2-{[(2E)-3-(4-chlorophenyl)-2-cyanoprop-2-enoyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: N#C/C(=C\c1ccc(cc1)Cl)/C(=O)Nc1sc(c(c1C(=O)OC)C)C

STK548027
Synonyms: 5-cyano-6-{[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)N2CCc3c(C2)cc(c(c3)OC)OC)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK548029
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-7-tert-butyl-3-(3-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Cc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CCC(Cc1s2)C(C)(C)C

STK548030
Synonyms: 3-hydroxy-4-[(4-methylphenyl)carbonyl]-5-phenyl-1-(2-phenylethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1)CCc1ccccc1

STK548031
Synonyms: 3-(4-bromophenyl)-6-iodo-2-[(E)-2-(2-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Brc1ccc(cc1)n1c(/C=C/c2ccccc2[N+](=O)[O-])nc2c(c1=O)cc(cc2)I

STK548032
Synonyms: (1'R,2'R)-2'-(4-methoxyphenyl)-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

STK548033
Synonyms: 11-benzyl-3-(4-ethoxyphenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCOc1ccc(cc1)n1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1

STK548034
Synonyms: N'-[(1E)-1-(4-chlorophenyl)ethylidene]-4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzohydrazide
Smiles: Clc1ccc(cc1)/C(=N/NC(=O)c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])/C

STK548035
Synonyms: 1-ethoxy-3-(4-methoxyphenyl)quinoxalin-2(1H)-one4-oxide
Smiles: CCOn1c(=O)c(c2ccc(cc2)OC)[n+](c2c1cccc2)[O-]

STK548036
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-4-[(4-chlorobenzyl)oxy]-5-methoxyphenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1OCc1ccc(cc1)Cl)Br

STK548037
Synonyms: methyl(1R,2R,3S,3aS)-1-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(4-bromophenyl)-3-cyano-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H](c2ccc(cc2)Br)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccc(c(c1)Br)OC

STK548038
Synonyms: 11-(3,4-dimethylphenyl)-3-(2-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccccc1n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)C)C

STK548039
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-methylphenyl)methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK548040
Synonyms: ethyl4-[(4-acetylphenyl)amino]-6,8-dichloroquinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)C(=O)C)cc(cc2Cl)Cl

STK548041
Synonyms: 11-[4-(benzyloxy)phenyl]-3-(4-methylphenyl)-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Cc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccc(cc1)OCc1ccccc1)C(=O)C(F)(F)F

STK548042
Synonyms: methyl(1R,2R,3S,3aS)-1-[(3-bromo-4-methoxyphenyl)carbonyl]-3-cyano-2-[4-(dimethylamino)phenyl]-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H](c2ccc(cc2)N(C)C)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccc(c(c1)Br)OC

STK548043
Synonyms: N-[3-cyano-1-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl]benzenesulfonamide
Smiles: N#Cc1c(NS(=O)(=O)c2ccccc2)n(c2c1nc1ccccc1n2)c1ccccc1OC

STK548044
Synonyms: N-(diphenylmethyl)-2-[(5-phenyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1

STK548045
Synonyms: N-(4-bromophenyl)-4-[4-(prop-2-yn-1-yloxy)phenyl]phthalazin-1-amine
Smiles: C#CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc(cc1)Br

STK548047
Synonyms: 5-(4-bromophenyl)-4-[(4-chlorophenyl)carbonyl]-3-hydroxy-1-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)Br)c1ccccc1

STK548048
Synonyms: N-{2-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-3-phenylpropanamide
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)Nc1sc2c(n1)cc(c(c2)C)C)CCc1ccccc1

STK548050
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)ccc1OCc1ccccc1

STK548051
Synonyms: [(4-bromophenyl)sulfonyl][3-(1-methyl-1H-imidazol-3-ium-3-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccn(c2)C)C(=O)c2c(C1=O)cccc2

STK548052
Synonyms: N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC(=S)Nc1sc2c(c1C#N)CCCC2

STK548054
Synonyms: 2,6-dimethoxy-N-{[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl}benzamide
Smiles: COc1cccc(c1C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)OC

STK548056
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(naphthalen-1-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc2c1cccc2)cccc3

STK548057
Synonyms: propan-2-ylcyano(3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}quinoxalin-2-yl)acetate
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)C/C=C/c1ccccc1)C(=O)OC(C)C

STK548058
Synonyms: N-(2,4-dimethoxyphenyl)-10-methyl-8-phenyl-11-(3,4,5-trimethoxyphenyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2cc(OC)c(c(c2)OC)OC)c(nn1c1ccccc1)C

STK548060
Synonyms: 6-amino-4-(2-chloroquinolin-3-yl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCc1[nH]nc2c1C(C(=C(O2)N)C#N)c1cc2ccccc2nc1Cl

STK548061
Synonyms: (8S,8aR,11aS)-10-(4-fluorophenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)F)cccc3

STK548063
Synonyms: 6-{[4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]oxy}-2-methylpyridazin-3(2H)-one
Smiles: CCNc1nc(Oc2ccc(=O)n(n2)C)nc(n1)NC(C)(C)C

STK548064
Synonyms: 5-(2-acetyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-3-(2-methylphenyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: CC(=O)N1CCc2c(C1c1c(O)[nH]c(=S)n(c1=O)c1ccccc1C)cccc2

STK548065
Synonyms: ethyl[6-amino-5-cyano-4-(cyclohex-2-en-1-yl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate
Smiles: CCOC(=O)Cc1[nH]nc2c1C(C1CCCC=C1)C(=C(O2)N)C#N

STK548066
Synonyms: 2-[(6,6-dimethyl-2-phenyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(4-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK548067
Synonyms: N-(2,4-dimethylphenyl)-10-methyl-8-phenyl-11-(3,4,5-trimethoxyphenyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1c(OC)cc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1C)C)c1ccccc1

STK548068
Synonyms: 1-(4-fluorophenyl)-3-hydroxy-5-(4-methylphenyl)-4-[(4-methylphenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)C1C(=C(C(=O)N1c1ccc(cc1)F)O)C(=O)c1ccc(cc1)C

STK548069
Synonyms: 3-(1-methyl-1H-indol-3-yl)-1-(naphthalen-2-yl)pyrrolidine-2,5-dione
Smiles: O=C1CC(C(=O)N1c1ccc2c(c1)cccc2)c1cn(c2c1cccc2)C

STK548070
Synonyms: 1-(5,6-dimethyl-1H-benzimidazol-1-yl)-3-(naphthalen-1-yloxy)propan-2-ol
Smiles: OC(Cn1cnc2c1cc(C)c(c2)C)COc1cccc2c1cccc2

STK548071
Synonyms: (5E)-2-[4-(3-chlorophenyl)piperazin-1-yl]-5-{2-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazol-4(5H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccccc2OCc2ccc(cc2)[N+](=O)[O-])/S1

STK548072
Synonyms: 2-(piperidin-1-yl)-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)acetamide
Smiles: O=C(CN1CCCCC1)NCC12CC3CC(C2)CC(C1)C3

STK548073
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(naphthalen-1-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2N=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc2c1cccc2)cccc3

STK548074
Synonyms: (2E)-2-{[8-(benzyloxy)quinolin-2-yl]methylidene}hydrazinecarboxamide
Smiles: NC(=O)N/N=C/c1ccc2c(n1)c(ccc2)OCc1ccccc1

STK548075
Synonyms: 4-bromo-N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]benzamide
Smiles: N#Cc1c(NC(=S)NC(=O)c2ccc(cc2)Br)sc2c1CCCCC2

STK548076
Synonyms: 4-{(2Z)-2-[3-chloro-5-(4-fluorophenyl)-2-(4-methylphenyl)-1-benzoxepin-4(5H)-ylidene]ethyl}morpholine
Smiles: Cc1ccc(cc1)C1=C(Cl)/C(=C\CN2CCOCC2)/C(c2c(O1)cccc2)c1ccc(cc1)F

STK548077
Synonyms: 2-{[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl}-N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1nnc(s1)SCc1ccccc1)c1ccc2c(c1)OCO2

STK548078
Synonyms: (3S)-2-{2-[(2-chlorobenzyl)oxy]phenyl}-3-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)cyclopropane-1,1-dicarbonitrile
Smiles: N#CC1(C#N)[C@H](C1c1ccccc1OCc1ccccc1Cl)C(=O)C12CC3CC(C2)CC(C1)C3

STK548079
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[3-(1H-benzotriazol-1-ylmethyl)-4-methoxyphenyl]methylidene}-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1Cn1nnc2c1cccc2)/C=N/NC(=O)c1nnn(c1CN1CCN(CC1)C)c1nonc1N

STK548080
Synonyms: 3-hydroxy-4-[(4-methylphenyl)carbonyl]-5-(3-nitrophenyl)-1-(2-phenylethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])CCc1ccccc1

STK548081
Synonyms: N-[(E)-{4-[(4-methyl-3,6-dihydro-2H-pyran-3-yl)oxy]phenyl}methylidene]-4-(nonyloxy)aniline
Smiles: CCCCCCCCCOc1ccc(cc1)/N=C/c1ccc(cc1)OC1COCC=C1C

STK548082
Synonyms: 3-[5-(2-bromo-4-chlorophenoxy)pentyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1ccc(cc1Br)Cl

STK548083
Synonyms: 2-imino-1-methyl-5-oxo-N-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: O=C(c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1)NCCc1ccccc1

STK548085
Synonyms: 5-(4-chlorophenyl)-3-hydroxy-1-(4-methylphenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C1N(c2ccc(cc2)C)C(=O)C(=C1C(=O)c1ccccc1)O

STK548086
Synonyms: 2-methyl-7-{[2-(2-methylpiperidin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: Cc1ccc2c(c1)[nH]c1c(o2)cc(c2c1c(=O)c1c(c2=O)cccc1)NCCN1CCCCC1C

STK548087
Synonyms: 2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-3-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Cn1c(SCc2ccc3c(c2)OCO3)nc2c(c1=O)c1CCCCc1s2

STK548088
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(2-chloro-6-fluorobenzyl)oxy]-3-methoxyphenyl}methylidene]-5-(phenoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)ccc1OCc1c(F)cccc1Cl

STK548089
Synonyms: 4-amino-N'-[(E)-(2-methoxynaphthalen-1-yl)methylidene]-1,2,5-oxadiazole-3-carbohydrazonamide
Smiles: COc1ccc2c(c1/C=N/N=C(/c1nonc1N)\N)cccc2

STK548090
Synonyms: 5-(4-chlorobenzyl)-4-(2-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(cc1)Cc1nnc(n1c1ccccc1C)S

STK548091
Synonyms: (8S,8aR,11aS)-10-(4-acetylphenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)C(=O)C)cccc3

STK548092
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-4-[(3-chlorobenzyl)oxy]-5-ethoxyphenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1OCc1cccc(c1)Cl)Br

STK548093
Synonyms: N-[3-(3,6-dichloro-9H-carbazol-9-yl)-2-hydroxypropyl]-N-(4-fluorophenyl)-4-methylbenzenesulfonamide
Smiles: Fc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)CC(Cn1c2ccc(cc2c2c1ccc(c2)Cl)Cl)O

STK548094
Synonyms: (1'R,2'R)-2'-phenyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: O=C([C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccccc1)C(=O)c1c(C2=O)cccc1)c1ccccc1

STK548095
Synonyms: (9E)-3-(4-chlorophenyl)-9-(4-methoxybenzylidene)-5-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: COc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)/C(=C/c1ccc(cc1)OC)/CCC2

STK548096
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(2-chlorobenzyl)oxy]phenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccccc1COc1cccc(c1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK548097
Synonyms: (5E)-2-[4-(naphthalen-1-yl)piperazin-1-yl]-5-{4-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1ccc(cc1)OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1cccc2c1cccc2

STK548098
Synonyms: 2-amino-N-(2,5-dimethylphenyl)-1-(3,5-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1ccc(c(c1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C)C

STK548099
Synonyms: 3-[3-(2-bromo-4-methylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1Br)C

STK548100
Synonyms: 4-[5-(2-methoxyphenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzamide
Smiles: COc1ccccc1Oc1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)C(=O)N

STK548103
Synonyms: ethyl3-{4-cyano-1-[(4-fluorophenyl)amino]-3-methylpyrido[1,2-a]benzimidazol-2-yl}propanoate
Smiles: CCOC(=O)CCc1c(C)c(C#N)c2n(c1Nc1ccc(cc1)F)c1ccccc1n2

STK548104
Synonyms: 4-[3-acetyl-4-hydroxy-2-(3-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzoicacid
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)C(=O)O

STK548105
Synonyms: 2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N,N-dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3)CCC

STK548106
Synonyms: 3-{4-(4-ethoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1cccnc1

STK548107
Synonyms: 2-amino-1-(3,4-dichlorophenyl)-N-(3,4-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1cc(ccc1C)NC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc(c(c1)Cl)Cl

STK548108
Synonyms: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-7-methyl-3-{(Z)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: OCCN1CCN(CC1)c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC1CCCO1)C

STK548110
Synonyms: N-{(2Z,4E)-1-[(4-methoxyphenyl)amino]-1-oxo-5-phenylpenta-2,4-dien-2-yl}benzamide
Smiles: COc1ccc(cc1)NC(=O)/C(=C/C=C/c1ccccc1)/NC(=O)c1ccccc1

STK548112
Synonyms: (6aS,6bR,9aS,10R)-10-[(3-bromo-4-methoxyphenyl)carbonyl]-8-(2,4-dichlorophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1Cl)Cl)C=Cc1c2cccc1

STK548113
Synonyms: 4-chloro-N-{(1E)-1-(3,4-diethoxyphenyl)-3-[(2-hydroxyethyl)amino]-3-oxoprop-1-en-2-yl}benzamide
Smiles: OCCNC(=O)/C(=C\c1ccc(c(c1)OCC)OCC)/NC(=O)c1ccc(cc1)Cl

STK548114
Synonyms: N'-[(E)-(2-fluorophenyl)methylidene]-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetohydrazide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1ccccc1F

STK548115
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548116
Synonyms: 4-{6-[(3-chloro-4-fluorophenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzene-1,2-diol
Smiles: Cc1nn(c2c1C(c1ccc(c(c1)O)O)n1c(=N2)c(Nc2ccc(c(c2)Cl)F)nc2c1cccc2)c1ccccc1

STK548117
Synonyms: 2-(2,4-dimethoxyphenyl)-10-iminotetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile
Smiles: N#CC12C(=N)OC3(OC1c1ccc(cc1OC)OC)C(C2(C#N)C#N)CCCC3

STK548118
Synonyms: (8S,8aR,11aS)-10-(4-acetylphenyl)-8-[(4-chlorophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1N=Cc1c2cccc1)c1ccc(cc1)C(=O)C

STK548119
Synonyms: 3-(4-benzylpiperazin-1-yl)-4-chloro-1-(2,5-dichlorophenyl)-1H-pyrrole-2,5-dione
Smiles: Clc1ccc(c(c1)N1C(=O)C(=C(C1=O)Cl)N1CCN(CC1)Cc1ccccc1)Cl

STK548120
Synonyms: 2-[(2-methoxyphenyl)amino]-2-oxoethylN'-cyano-N-(3-fluorophenyl)carbamimidothioate
Smiles: N#C/N=C(\Nc1cccc(c1)F)/SCC(=O)Nc1ccccc1OC

STK548121
Synonyms: 4-methoxy-N-[(4-methoxyphenyl)carbonyl]-N-(4-methylpyridin-2-yl)benzamide
Smiles: COc1ccc(cc1)C(=O)N(C(=O)c1ccc(cc1)OC)c1nccc(c1)C

STK548123
Synonyms: 2-(4-methoxyphenyl)-3-{3-[2-methyl-5-(propan-2-yl)phenoxy]propyl}quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(ccc1C)C(C)C

STK548124
Synonyms: (2E)-3-(5-iodofuran-2-yl)prop-2-enoicacid
Smiles: OC(=O)/C=C/c1ccc(o1)I

STK548126
Synonyms: N-(3-methoxyphenyl)-2-[(5-phenyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK548128
Synonyms: (5E)-4-bromo-5-{[(2,4-dibromophenyl)carbamoyl]imino}-3-(1-phenylpropan-2-yl)-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Smiles: Brc1ccc(c(c1)Br)NC(=O)/N=C\1/ON=[N+]([C-]1Br)C(Cc1ccccc1)C

STK548129
Synonyms: N-benzyl-2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)NCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548130
Synonyms: ethyl4-{[3-cyano-6-methyl-4-(thiophen-3-yl)pyridin-2-yl]sulfanyl}-3-oxobutanoate
Smiles: CCOC(=O)CC(=O)CSc1nc(C)cc(c1C#N)c1cscc1

STK548131
Synonyms: 4-(4-butoxy-6-methyl-5-nitropyrimidin-2-yl)morpholine
Smiles: CCCCOc1nc(nc(c1[N+](=O)[O-])C)N1CCOCC1

STK548132
Synonyms: 2-amino-1-(4-ethoxyphenyl)-N-phenyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1ccccc1

STK548133
Synonyms: 4-[(8S,8aR,11aS)-8-[(4-methoxyphenyl)carbonyl]-9,11-dioxo-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-10(11H)-yl]phenylacetate
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1C=Cc1c2cccc1)c1ccc(cc1)OC(=O)C

STK548134
Synonyms: 5-bromo-N-(furan-2-ylmethyl)-2,3,4-trimethylbenzamide
Smiles: O=C(c1cc(Br)c(c(c1C)C)C)NCc1ccco1

STK548135
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl

STK548136
Synonyms: 3-butyl-2-(hexylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCn1c(SCCCCCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548137
Synonyms: 2-(4-methoxyphenyl)-3-[2-(2,3,6-trimethylphenoxy)ethyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1c(C)ccc(c1C)C

STK548138
Synonyms: 5-amino-6-(ethylsulfanyl)-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Smiles: CCSc1nc2n(ncc2c(=O)n1N)c1ccccc1

STK548140
Synonyms: 10-hexanoyl-3-(4-methylphenyl)-11-[4-(propan-2-yloxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCCC(=O)N1C(c2ccc(cc2)OC(C)C)C2=C(Nc3c1cccc3)CC(CC2=O)c1ccc(cc1)C

STK548141
Synonyms: 2-[1-oxo-1-(2,2,4,6,8-pentamethylquinolin-1(2H)-yl)-3-phenylpropan-2-yl]-1H-isoindole-1,3(2H)-dione
Smiles: Cc1cc(C)c2c(c1)C(=CC(N2C(=O)C(N1C(=O)c2c(C1=O)cccc2)Cc1ccccc1)(C)C)C

STK548143
Synonyms: N-[4-(acetylamino)phenyl]-2-[(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCCn1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548144
Synonyms: 4-{[3,6-bis(ethoxycarbonyl)quinolin-4-yl]amino}benzoicacid
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)C(=O)O)cc(cc2)C(=O)OCC

STK548146
Synonyms: 4-[3-acetyl-4-hydroxy-2-(4-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoicacid
Smiles: OC(=O)CCCN1C(c2ccc(cc2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)C

STK548147
Synonyms: 5-(4-ethoxyphenyl)-3-(4-methoxyphenyl)-2,3a-diphenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=O)C2C(C1=O)(c1ccccc1)C(N(O2)c1ccccc1)c1ccc(cc1)OC

STK548148
Synonyms: 1-(4-methoxy-6-methylpyrimidin-2-yl)thiourea
Smiles: COc1cc(C)nc(n1)NC(=S)N

STK548151
Synonyms: 8-bromo-1,3-dimethyl-7-[2-(4-methylpiperidin-1-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCN(CC1)CCn1c(Br)nc2c1c(=O)n(C)c(=O)n2C

STK548152
Synonyms: ethyl3,3,3-trifluoro-2-(pentanoylamino)-N-[6-(propan-2-yl)-1,3-benzothiazol-2-yl]alaninate
Smiles: CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1nc2c(s1)cc(cc2)C(C)C

STK548154
Synonyms: 3-[3-(2,5-dichlorophenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(Cl)ccc1Cl

STK548155
Synonyms: propan-2-yl2-amino-1-(3-chloro-4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COc1ccc(cc1Cl)n1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK548159
Synonyms: 4-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylamino)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-2-methoxyphenyl4-chlorobenzoate
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(c(c1)OC)OC(=O)c1ccc(cc1)Cl)CC

STK548160
Synonyms: propan-2-yl2-amino-1-(3-chlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)Cl)C

STK548161
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: O=C1NC(=O)[C@H]2[C@@H]1[C@@H](C(=O)c1ccc(cc1)Cl)N1C2c2ccccc2C=C1

STK548162
Synonyms: 2-acetylphenyl2-(4-ethoxyphenyl)quinoline-4-carboxylate
Smiles: CCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Oc1ccccc1C(=O)C

STK548163
Synonyms: naphthalen-1-yl2-chloroquinoline-4-carboxylate
Smiles: Clc1nc2ccccc2c(c1)C(=O)Oc1cccc2c1cccc2

STK548165
Synonyms: 2-[(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide
Smiles: CCCCn1c(SCC(=O)Nc2ccc(cc2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548166
Synonyms: [(4-bromophenyl)sulfonyl][3-(4-tert-butylpyridinium-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccc(cc2)C(C)(C)C)C(=O)c2c(C1=O)cccc2

STK548167
Synonyms: 3-[2-(2,5-dichlorophenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(Cl)ccc1Cl

STK548168
Synonyms: 1-amino-N-(2-chlorophenyl)-8,8-dimethyl-5-(morpholin-4-yl)-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)SCc1c(n2)N1CCOCC1)Nc1ccccc1Cl

STK548169
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-chlorophenyl)methylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)Cl

STK548171
Synonyms: (5E)-2-[4-(2-methylphenyl)piperazin-1-yl]-5-{2-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1ccccc1C

STK548172
Synonyms: N-(2,4-dimethylphenyl)-2-[(4-oxo-3-phenyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCC3

STK548173
Synonyms: methyl[(2-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nc(nc2c1c1CCCCc1s2)c1ccccc1

STK548174
Synonyms: ethyl2-amino-1-(4-{[(2E)-3-phenylprop-2-enoyl]amino}phenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc(cc1)NC(=O)/C=C/c1ccccc1

STK548175
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-ethoxy-4-[(3-fluorobenzyl)oxy]phenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc1OCc1cccc(c1)F

STK548177
Synonyms: 1-benzyl-2-imino-N,10-dimethyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: CNC(=O)c1cc2c(n(c1=N)Cc1ccccc1)nc1n(c2=O)cccc1C

STK548178
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(naphthalen-2-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1C=Cc1c2cccc1)c1ccc2c(c1)cccc2

STK548179
Synonyms: (3E)-N-(3-chloro-4-methoxyphenyl)-3-{2-[(3-hydroxyphenyl)carbonyl]hydrazinylidene}butanamide
Smiles: COc1ccc(cc1Cl)NC(=O)C/C(=N/NC(=O)c1cccc(c1)O)/C

STK548180
Synonyms: 1-amino-8,8-dimethyl-5-(pyrrolidin-1-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carbohydrazide
Smiles: NNC(=O)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCCC1

STK548181
Synonyms: methyl2-[(8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-9,11-dioxo-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazin-10(11H)-yl]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)N=Cc2c1cccc2

STK548182
Synonyms: 2-(benzylsulfanyl)-5-[(4-nitrobenzyl)sulfanyl]-1,3,4-thiadiazole
Smiles: [O-][N+](=O)c1ccc(cc1)CSc1nnc(s1)SCc1ccccc1

STK548183
Synonyms: 1-methoxypropan-2-yl2-amino-1-[2-(4-sulfamoylphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(cc1)S(=O)(=O)N)C

STK548185
Synonyms: ethyl6-methyl-4-{[4-(propoxycarbonyl)phenyl]amino}quinoline-3-carboxylate
Smiles: CCCOC(=O)c1ccc(cc1)Nc1c(cnc2c1cc(C)cc2)C(=O)OCC

STK548186
Synonyms: 4-methyl-2-[(Z)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]phenyl2-nitrobenzoate
Smiles: Cc1ccc(c(c1)/C=C/1\Sc2c(C1=O)cccc2)OC(=O)c1ccccc1[N+](=O)[O-]

STK548187
Synonyms: N'-[(1E)-8-methoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]pyridine-4-carbohydrazide
Smiles: COc1ccc2c(c1)c1/c(=N\NC(=O)c3ccncc3)/ssc1C(N2)(C)C

STK548188
Synonyms: methyl3,3,3-trifluoro-N-[(4-fluorophenyl)carbonyl]-2-({5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}amino)alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1)F)Nc1ncc(s1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

STK548189
Synonyms: 2-(2-fluorophenyl)-4-(4-methylpiperazin-1-yl)quinazoline
Smiles: CN1CCN(CC1)c1nc(nc2c1cccc2)c1ccccc1F

STK548190
Synonyms: 2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-6-methoxyphenylbenzoate
Smiles: COc1cccc(c1OC(=O)c1ccccc1)/C=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N

STK548191
Synonyms: N-{3-phenyl-3-[4-(propan-2-yloxy)phenyl]propyl}benzamide
Smiles: CC(Oc1ccc(cc1)C(c1ccccc1)CCNC(=O)c1ccccc1)C

STK548193
Synonyms: 3-[2-(4-chloro-3,5-dimethylphenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(C)c(c(c1)C)Cl

STK548194
Synonyms: 3-(2-phenylethyl)-11-(tetrahydrofuran-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: O=c1n(CCc2ccccc2)cnc2c1c1nc3ccccc3nc1n2CC1CCCO1

STK548195
Synonyms: N-(12-cyanoindolizino[2,3-b]quinoxalin-2-yl)thiophene-2-carboxamide
Smiles: N#Cc1c2cc(ccn2c2c1nc1ccccc1n2)NC(=O)c1cccs1

STK548196
Synonyms: N-{2-[(5-chloropyridin-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-2-iodobenzamide
Smiles: Clc1ccc(nc1)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccccc1I

STK548199
Synonyms: 2-[(3,4-dichlorobenzyl)sulfanyl]-3-(4-ethoxyphenyl)quinazolin-4(3H)-one
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(c(c2)Cl)Cl)nc2c(c1=O)cccc2

STK548200
Synonyms: N'~1~-[(3E)-5-bromo-2-oxo-1-(propan-2-yl)-1,2-dihydro-3H-indol-3-ylidene]-N'~7~-[(3Z)-5-bromo-2-oxo-1-(propan-2-yl)-1,2-dihydro-3H-indol-3-ylidene]heptanedihydrazide
Smiles: CC(N1C(=O)/C(=N/NC(=O)CCCCCC(=O)N/N=C/2\C(=O)N(c3c2cc(Br)cc3)C(C)C)/c2c1ccc(c2)Br)C

STK548201
Synonyms: 4-methyl-7-(2-{[2-(morpholin-4-yl)ethyl]sulfanyl}ethoxy)-2H-chromen-2-one
Smiles: O=c1cc(C)c2c(o1)cc(cc2)OCCSCCN1CCOCC1

STK548202
Synonyms: N,N-dibutyl-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3)CCCC

STK548204
Synonyms: 3-chloro-N-[1-(1-hexyl-1H-benzimidazol-2-yl)ethyl]benzamide
Smiles: CCCCCCn1c(nc2c1cccc2)C(NC(=O)c1cccc(c1)Cl)C

STK548205
Synonyms: 2-[(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N,N-dipropylacetamide
Smiles: CCCCn1c(SCC(=O)N(CCC)CCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548206
Synonyms: N-[(2-hydroxyquinolin-3-yl)methyl]-2-methoxy-N-(2-methylphenyl)benzamide
Smiles: COc1ccccc1C(=O)N(c1ccccc1C)Cc1cc2ccccc2nc1O

STK548207
Synonyms: methyl5-bromo-3-[(phenylcarbonyl)amino]-1-benzofuran-2-carboxylate
Smiles: COC(=O)c1oc2c(c1NC(=O)c1ccccc1)cc(cc2)Br

STK548208
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(naphthalen-1-ylmethoxy)phenyl]methylidene}-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccccc1)c1nonc1N)N/N=C/c1ccc(cc1)OCc1cccc2c1cccc2

STK548209
Synonyms: 2-[(3,3-dimethylpiperidin-1-yl)carbonyl]-1-[(2-hydroxyethyl)amino]anthracene-9,10-dione
Smiles: OCCNc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)N1CCCC(C1)(C)C

STK548211
Synonyms: (2E)-N-(2-{(2Z)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)-3-phenylprop-2-enamide(non-preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)/C=C/c2ccccc2)/c2c1cccc2

STK548212
Synonyms: ethyl5-(acetyloxy)-2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-6-bromo-1-phenyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(CSc2nc3c(s2)cccc3)n(c2c1cc(OC(=O)C)c(c2)Br)c1ccccc1

STK548213
Synonyms: ethyl2-({[(2Z)-3-(4-bromophenyl)prop-2-enoyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)/C=C\c2ccc(cc2)Br)sc2c1CCCC2

STK548214
Synonyms: naphthalen-1-yl2-(4-bromophenyl)-8-methylquinoline-4-carboxylate
Smiles: Brc1ccc(cc1)c1cc(C(=O)Oc2cccc3c2cccc3)c2c(n1)c(C)ccc2

STK548215
Synonyms: 1-(2-ethyl-1H-benzimidazol-1-yl)-3-[5-methyl-2-(propan-2-yl)phenoxy]propan-2-ol
Smiles: CCc1nc2c(n1CC(COc1cc(C)ccc1C(C)C)O)cccc2

STK548216
Synonyms: {methyl4-[3-{bis[2-(hydroxy-kappaO)ethyl]amino-kappaN}-2-(hydroxy-kappaO)propoxy]benzoatato(3-)}boron
Smiles: COC(=O)c1ccc(cc1)OCC1O[B-]23[N+](C1)(CCO3)CCO2

STK548217
Synonyms: 9-(ethylsulfanyl)-8-(2-methylprop-2-en-1-yl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCc1c3cccc1

STK548218
Synonyms: (2E)-2-{[8-(benzyloxy)quinolin-2-yl]methylidene}hydrazinecarbothioamide
Smiles: NC(=S)N/N=C/c1ccc2c(n1)c(ccc2)OCc1ccccc1

STK548219
Synonyms: 3-[2-(2-bromophenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccccc1Br

STK548220
Synonyms: 11-(2-methoxyphenyl)-10-methyl-N-(4-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)C)c1ccccc1

STK548222
Synonyms: N-(diphenylmethyl)-2-{[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

STK548224
Synonyms: (8S,8aR,11aS)-8-[(3-nitrophenyl)carbonyl]-10-phenyl-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: O=C([C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3)c1cccc(c1)[N+](=O)[O-]

STK548225
Synonyms: 6-(4-chlorophenyl)-8-phenyl-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)Sc1c(C2c2ccccc2)sc(=O)[nH]1

STK548226
Synonyms: ethyl4-{2-(2-fluorophenyl)-4-hydroxy-3-[(4-methoxyphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1F)C(=O)c1ccc(cc1)OC)O

STK548227
Synonyms: ethyl2-({[(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl]acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc(C)c(c(c2C#N)C)C)sc2c1CCC2

STK548228
Synonyms: 4-ethyl-2,6-bis(4-methoxyphenyl)-9,10-diphenylhexahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetrone
Smiles: COc1ccc(cc1)N1C(=O)C2C(C1=O)C1(CC)C3C(C2C(=C1c1ccccc1)c1ccccc1)C(=O)N(C3=O)c1ccc(cc1)OC

STK548230
Synonyms: 1-methoxypropan-2-yl2-amino-1-(4-bromophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Br)C

STK548231
Synonyms: 3-(3,3-dimethylpiperidin-1-yl)-5-[(2-methylphenyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: Cc1ccccc1Nc1cc(N2CCCC(C2)(C)C)c2c3c1C(=O)c1ccccc1c3on2

STK548232
Synonyms: N'-[(1E)-1-(4-chlorophenyl)ethylidene]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(s1)C)N/N=C(/c1ccc(cc1)Cl)\C

STK548233
Synonyms: ethyl4-cyano-5-[({[3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetyl)amino]-3-methylthiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nc2CCCCc2c(c1C#N)c1ccc(cc1)OC

STK548236
Synonyms: 3-(2-chlorophenyl)-8-[(dimethylamino)methyl]-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CN(Cc1c(O)ccc2c1oc(c(c2=O)c1ccccc1Cl)C(F)(F)F)C

STK548237
Synonyms: 2-{[(tricyclo[4.3.1.1~3,8~]undec-3-ylmethyl)amino]methyl}phenol
Smiles: Oc1ccccc1CNCC12CCC3CC(C1)CC(C2)C3

STK548238
Synonyms: 2-(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)-N-[(3-methylphenyl)carbamothioyl]acetamide
Smiles: O=C(CC1SC(=O)N(C1=O)c1ccccc1)NC(=S)Nc1cccc(c1)C

STK548240
Synonyms: 4-acetyl-3-hydroxy-1-(4-methoxyphenyl)-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)N1C(=O)C(=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)C)O

STK548242
Synonyms: (4Z)-2-(4-chloro-3-nitrophenyl)-4-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)c1ccc(c(c1)[N+](=O)[O-])Cl

STK548243
Synonyms: N-(3-chloro-4-methoxyphenyl)-10-methyl-8-phenyl-11-(thiophen-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccs2)c(nn1c1ccccc1)C

STK548245
Synonyms: 2-amino-1-(3,5-dichlorophenyl)-N-phenyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Clc1cc(Cl)cc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)Nc1ccccc1

STK548247
Synonyms: ethyl5-bromo-3-[(3,3-diphenylpropanoyl)amino]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CC(c1ccccc1)c1ccccc1)cc(cc2)Br

STK548248
Synonyms: methyl3,3,3-trifluoro-N-[(2-methylphenyl)carbonyl]-2-({5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}amino)alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1C)Nc1ncc(s1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

STK548249
Synonyms: 4-[(4-chlorophenyl)carbonyl]-1-(4-fluorophenyl)-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)N1C(=O)C(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)c1ccc(cc1)Cl)O

STK548251
Synonyms: 11-(4-ethoxyphenyl)-3-(furan-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)Cc1ccco1

STK548252
Synonyms: N-[4-(acetylamino)phenyl]-2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK548253
Synonyms: (8S,8aR,11aS)-10-(2-chlorophenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Cl)cccc3

STK548254
Synonyms: 9-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}-8-(2-methylprop-2-en-1-yl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CC(=C)Cn1c(SC/C=C(/Cl)\C)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK548255
Synonyms: 2-cyano-N'-[(4E)-1,2,5-trimethylpiperidin-4-ylidene]acetohydrazide
Smiles: CC1CN(C)C(C/C/1=N\NC(=O)CC#N)C

STK548257
Synonyms: ethyl2-[({[3-cyano-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc3CCN(Cc3c(c2C#N)c2cccs2)C)sc2c1CCCC2

STK548258
Synonyms: ethyl4-{[3-cyano-4-(2-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-3-oxobutanoate
Smiles: CCOC(=O)CC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccccc1OC

STK548259
Synonyms: diethyl4-(naphthalen-1-ylamino)quinoline-3,6-dicarboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1cccc3c1cccc3)cc(cc2)C(=O)OCC

STK548260
Synonyms: 2-phenyl-4-(propan-2-ylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: CC(Sc1nc(nc2c1c1CCCCc1s2)c1ccccc1)C

STK548261
Synonyms: propan-2-yl2-amino-1-(2-chlorobenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CC(OC(=O)c1c2nc3ccccc3nc2n(c1N)Cc1ccccc1Cl)C

STK548263
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-N'-{(E)-[5-(3-nitrophenyl)furan-2-yl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-]

STK548264
Synonyms: ethyl2-{[(2-chlorophenyl)carbonyl]amino}-1-(2-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2Cl)n(c2c1nc1ccccc1n2)c1ccccc1C

STK548265
Synonyms: N-{(E)-[4-(3-methylbutoxy)phenyl]methylidene}-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanamine
Smiles: CC(C12CC3CC(C2)CC(C1)C3)/N=C/c1ccc(cc1)OCCC(C)C

STK548266
Synonyms: 2-{[6-iodo-3-(4-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)C)I

STK548267
Synonyms: prop-2-en-1-yl2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OCC=C

STK548268
Synonyms: ethyl4-[2-(4-fluorophenyl)-4-hydroxy-5-oxo-3-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(c2ccc(cc2)F)C(=C(C1=O)O)C(=O)c1ccccc1

STK548269
Synonyms: 2-methoxyethyl2-amino-1-(3-butoxypropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCOCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OCCOC

STK548270
Synonyms: ethyl4-({[2-amino-1-(3,5-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxalin-3-yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK548271
Synonyms: 2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-4-[4-methyl-3-(piperidin-1-ylsulfonyl)phenyl]phthalazin-1(2H)-one
Smiles: CN1CCN(CC1)C(=O)Cn1nc(c2ccc(c(c2)S(=O)(=O)N2CCCCC2)C)c2c(c1=O)cccc2

STK548272
Synonyms: 5-(4-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]-3-{[3-(trifluoromethyl)phenyl]amino}-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=CC(N1c1cccc(c1)C(F)(F)F)c1ccc(cc1)[N+](=O)[O-])Nc1cccc(c1)C(F)(F)F

STK548273
Synonyms: N-(3-chloro-4-fluorophenyl)-11-(4-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Fc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)F)c1ccccc1

STK548274
Synonyms: 2-[(5-ethyl-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)OC)nn2)CC(OC3)(C)C

STK548275
Synonyms: prop-2-en-1-ylcyano[3-(4-methylpiperazin-1-yl)quinoxalin-2-yl]acetate
Smiles: C=CCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C)C#N

STK548276
Synonyms: 2-cyano-N-(1-phenylethyl)-2-[3-(piperidin-1-yl)quinoxalin-2-yl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCCCC1)C(=O)NC(c1ccccc1)C

STK548277
Synonyms: 5-methyl-2-(propan-2-yl)cyclohexyl[(2,4-dichlorophenyl)(hydroxy)methyl][4-(dimethylamino)phenyl]phosphinate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1Cl)Cl)O)c1ccc(cc1)N(C)C)C(C)C

STK548278
Synonyms: ethyl(1R,2S,3S)-3-[(4-chlorophenyl)carbamoyl]-1-cyano-2-phenyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinoline-1-carboxylate
Smiles: CCOC(=O)[C@]1(C#N)[C@H](c2ccccc2)[C@H](N2C1c1ccccc1C=C2)C(=O)Nc1ccc(cc1)Cl

STK548279
Synonyms: methyl2-amino-1-(4-pentylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCCc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)OC

STK548280
Synonyms: 11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)OC

STK548281
Synonyms: ethyl(2E,3E)-3-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)-2-(hydroxyimino)butanoate
Smiles: CCOC(=O)/C(=N/O)/C(=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)/C

STK548283
Synonyms: N'-[(E)-(4-hydroxyphenyl)methylidene]-4-[(2-methylbenzo[h]quinolin-4-yl)amino]benzohydrazide
Smiles: Oc1ccc(cc1)/C=N/NC(=O)c1ccc(cc1)Nc1cc(C)nc2c1ccc1c2cccc1

STK548284
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(3-chlorobenzyl)oxy]phenyl}methylidene]-5-[(diethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)OCc1cccc(c1)Cl)CC

STK548286
Synonyms: propan-2-yl2-amino-1-(1-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CC(OC(=O)c1c2nc3ccccc3nc2n(c1N)C(c1ccccc1)C)C

STK548288
Synonyms: (9E)-3-(4-bromophenyl)-9-(2,4-dichlorobenzylidene)-5-(2,4-dichlorophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: Clc1ccc(c(c1)Cl)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Br)/C(=C/c1ccc(cc1Cl)Cl)/CCC2

STK548289
Synonyms: methyl2-({(2Z)-2-cyano-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: N#C/C(=C/c1ccc(cc1)C(C)C)/C(=O)Nc1sc2c(c1C(=O)OC)CCC2

STK548290
Synonyms: N-[1-(1H-benzimidazol-2-yl)butyl]-3,5-dinitrobenzamide
Smiles: CCCC(c1nc2c([nH]1)cccc2)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

STK548291
Synonyms: 4-fluoro-N-(2-methoxyphenazin-1-yl)benzamide
Smiles: COc1ccc2c(c1NC(=O)c1ccc(cc1)F)nc1c(n2)cccc1

STK548292
Synonyms: N-(2,5-dimethylphenyl)-11-(4-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Fc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cc(C)ccc1C)nc1c2cccc1

STK548293
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc1OCc1ccccc1F

STK548294
Synonyms: 2-methoxyethyl2-amino-1-(3,4-dichlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)Cl

STK548295
Synonyms: 1-(1,3-benzodioxol-5-yl)-2-{[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: Clc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)OCO3)nnc1c1ccncc1

STK548296
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-chlorophenyl)carbonyl]-2-(3,5-dichlorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl)C(=O)c1ccccc1

STK548297
Synonyms: 3-[(Z)-(3-cyclopentyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(2-hydroxyethyl)piperazin-1-yl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: OCCN1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCC1

STK548299
Synonyms: 4-bromo-2-{(E)-[(5-bromopyridin-2-yl)imino]methyl}naphthalen-1-ol
Smiles: Brc1ccc(nc1)/N=C/c1cc(Br)c2c(c1O)cccc2

STK548300
Synonyms: 4-bromo-N-(2-{(2Z)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccc(cc2)Br)/c2c1cccc2

STK548301
Synonyms: 3-[2-(cyclohex-1-en-1-yl)ethyl]-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: Oc1[nH]c(=S)n(c(=O)c1C1NCCc2c1cccc2)CCC1=CCCCC1

STK548302
Synonyms: 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)S)C

STK548304
Synonyms: N-(2,4-dimethylphenyl)-10-methyl-8-phenyl-11-[4-(propan-2-yl)phenyl]-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1ccc(c(c1)C)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)C(C)C)C)c1ccccc1

STK548305
Synonyms: 2-[4-(benzyloxy)-3-methoxyphenyl]-1H-phenanthro[9,10-d]imidazole
Smiles: COc1cc(ccc1OCc1ccccc1)c1nc2c([nH]1)c1ccccc1c1c2cccc1

STK548306
Synonyms: (3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(4-chlorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)Cl)C(=O)c1ccccc1

STK548307
Synonyms: 2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N,N-dipropylacetamide
Smiles: C=CCn1c(SCC(=O)N(CCC)CCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548309
Synonyms: 4-(phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)-8-(naphthalen-1-yl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: O=C([C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc3c1cccc3)C=Cc1c2cccc1)Oc1ccc(cc1)C(=O)c1ccccc1

STK548310
Synonyms: 2-(4-methoxyphenyl)-3-(3-{2-methoxy-4-[(1E)-prop-1-en-1-yl]phenoxy}propyl)quinazolin-4(3H)-one
Smiles: C/C=C/c1ccc(c(c1)OC)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK548311
Synonyms: 6-(azepan-1-yl)-N,N'-bis(2-chloro-5-methoxyphenyl)-1,3,5-triazine-2,4-diamine
Smiles: COc1ccc(c(c1)Nc1nc(nc(n1)N1CCCCCC1)Nc1cc(OC)ccc1Cl)Cl

STK548312
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK548313
Synonyms: N-(2,4-dimethylphenyl)-2-[(6,6-dimethyl-2-phenyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK548314
Synonyms: 3-hexyl-11-(4-methoxybenzyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc(cc1)OC

STK548315
Synonyms: N-(3,5-dichlorophenyl)-2-(2-fluorophenyl)quinazolin-4-amine
Smiles: Clc1cc(Cl)cc(c1)Nc1nc(nc2c1cccc2)c1ccccc1F

STK548316
Synonyms: 2-[(4-amino-6,8-diphenyl-5,8-dihydro-6H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-1-(4-bromophenyl)ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1

STK548318
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-phenylethylidene]-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCCCC1)c1nonc1N)N/N=C(/c1ccccc1)\C

STK548322
Synonyms: 3-(4-bromophenyl)-5-(3-chloro-4-methylphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Brc1ccc(cc1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)c1ccc(c(c1)Cl)C

STK548323
Synonyms: ethyl2-[({[3-cyano-4-(4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc3CCCc3c(c2C#N)c2ccc(cc2)OC)sc2c1CCCC2

STK548324
Synonyms: 2-{[3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(2,5-dimethoxyphenyl)acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2cc(OC)ccc2OC)c(c(c1)c1cccs1)C#N

STK548325
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-butoxyphenyl)methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK548327
Synonyms: 4-(4-benzylpiperazin-1-yl)-5-(biphenyl-4-yl)thieno[2,3-d]pyrimidine
Smiles: c1ccc(cc1)CN1CCN(CC1)c1ncnc2c1c(cs2)c1ccc(cc1)c1ccccc1

STK548329
Synonyms: [3-(4-{[(2-chlorophenyl)carbonyl]amino}pyridinium-1-yl)quinoxalin-2-yl](phenylsulfonyl)azanide
Smiles: O=C(c1ccccc1Cl)Nc1cc[n+](cc1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1

STK548330
Synonyms: 5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-3-{[3-(trifluoromethyl)phenyl]amino}-1,5-dihydro-2H-pyrrol-2-one
Smiles: Brc1ccc(cc1)C1C=C(C(=O)N1c1cccc(c1)C(F)(F)F)Nc1cccc(c1)C(F)(F)F

STK548331
Synonyms: N-(naphthalen-2-yl)-4-[4-(prop-2-yn-1-yloxy)phenyl]phthalazin-1-amine
Smiles: C#CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc2c(c1)cccc2

STK548332
Synonyms: 2-(3-bromo-4-fluorophenyl)-1H-phenanthro[9,10-d]imidazole
Smiles: Fc1ccc(cc1Br)c1nc2c([nH]1)c1ccccc1c1c2cccc1

STK548333
Synonyms: ethyl5-(3,5-dimethylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c1cc(C)cc(c1)C

STK548334
Synonyms: N,N-diethyl-N'-(7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)propane-1,3-diamine
Smiles: CCN(CCCNc1ncnc2c1c1CCC(Cc1s2)C)CC

STK548335
Synonyms: 2-[(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Smiles: CCCCn1c(SCC(=O)Nc2ccccc2OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548336
Synonyms: 1-methoxypropan-2-yl2-amino-1-(3-methoxypropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCCn1c2nc3ccccc3nc2c(c1N)C(=O)OC(COC)C

STK548337
Synonyms: 2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(s1)SCc1ccccc1

STK548338
Synonyms: 3-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}-5-(ethylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCSc1nc2sc3c(c2c2n1c(SC/C=C(/Cl)\C)nn2)CCCC3

STK548339
Synonyms: 1-(4-bromophenyl)-3-hydroxy-5-phenyl-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Brc1ccc(cc1)N1C(c2ccccc2)C(=C(C1=O)O)C(=O)c1ccccc1

STK548341
Synonyms: 2-methoxyethyl2-amino-1-benzyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK548342
Synonyms: [(4-chlorophenyl)sulfonyl][3-(piperidin-1-yl)quinoxalin-2-yl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)Cl)c1nc2ccccc2nc1N1CCCCC1

STK548343
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,5-dichloro-2-methoxyphenyl)methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)cc(cc1Cl)Cl

STK548344
Synonyms: 2-[(2,6-dichlorophenyl)amino]-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
Smiles: Cc1nc(sc1C(=O)Nc1ccccc1)Nc1c(Cl)cccc1Cl

STK548345
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(3-fluorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)F)cccc3

STK548346
Synonyms: 2-amino-N-(3,5-dimethylphenyl)-1-(3-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1cc(C)cc(c1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C

STK548348
Synonyms: (5Z)-5-[(1-methyl-1H-indol-3-yl)methylidene]-1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)/C(=C/c2cn(c3c2cccc3)C)/C(=O)N1CCc1ccccc1

STK548349
Synonyms: N-(4-methylphenyl)-2-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(s1)SCc1cccc2c1cccc2

STK548350
Synonyms: [3-(4-benzylpyridinium-1-yl)quinoxalin-2-yl][(5-bromothiophen-2-yl)sulfonyl]azanide
Smiles: Brc1ccc(s1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)Cc1ccccc1

STK548351
Synonyms: 11-(3,4-dichlorophenyl)-3-(2-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Clc1ccc(cc1Cl)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1

STK548352
Synonyms: methyl1-[4-(acetylamino)phenyl]-2-amino-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)NC(=O)C

STK548354
Synonyms: {3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}[(4-chlorophenyl)sulfonyl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)Cl)c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK548355
Synonyms: N-ethyl-5-(4-{[4-methoxy-3-(piperidin-1-ylcarbonyl)phenyl]amino}phthalazin-1-yl)-2-methylbenzenesulfonamide
Smiles: CCNS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)Nc1ccc(c(c1)C(=O)N1CCCCC1)OC

STK548356
Synonyms: ethyl6-bromo-2,4-bis[(dimethylamino)methyl]-5-hydroxy-1-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c2c(CN(C)C)c(O)c(cc2n(c1CN(C)C)C)Br

STK548357
Synonyms: N-[3-cyano-1-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl]-4-nitrobenzenesulfonamide
Smiles: N#Cc1c(NS(=O)(=O)c2ccc(cc2)[N+](=O)[O-])n(c2c1nc1ccccc1n2)c1ccccc1OC

STK548358
Synonyms: N-(2,4-dimethoxyphenyl)-10-methyl-8,11-diphenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2)c(nn1c1ccccc1)C

STK548359
Synonyms: 11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-3-(4-chlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl

STK548361
Synonyms: 9-(4-chlorophenyl)-2-(4-ethylphenyl)tetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)N1N(C2c2ccc(cc2)Cl)CCC1

STK548362
Synonyms: 1-(4-acetylphenyl)-4-[(4-chlorophenyl)carbonyl]-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)C(=O)C

STK548365
Synonyms: 4-{4-(4-chlorophenyl)-5-[(3-methoxybenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: COc1cccc(c1)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK548366
Synonyms: 2-(trifluoromethyl)benzylN'-cyano-N-(4-ethoxyphenyl)carbamimidothioate
Smiles: CCOc1ccc(cc1)N/C(=N/C#N)/SCc1ccccc1C(F)(F)F

STK548367
Synonyms: (3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(2-fluorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1F)C(=O)c1ccccc1

STK548368
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}methylidene]-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1CSC1=NCCS1)/C=N/NC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N

STK548370
Synonyms: 3-(3,4-dimethylphenyl)-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidine-2,4(1H,3H)-dione
Smiles: Cc1ccc(cc1C)n1c(=O)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK548373
Synonyms: (5E)-2-[4-(2-methylphenyl)piperazin-1-yl]-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1cccs1)N1CCN(CC1)c1ccccc1C

STK548375
Synonyms: 6-(2-methylbutan-2-yl)-N-[3-(morpholin-4-yl)propyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Smiles: CCC(C1CCc2c(C1)c1c(NCCCN3CCOCC3)ncnc1s2)(C)C

STK548376
Synonyms: {3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}[(4-methylphenyl)sulfonyl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK548377
Synonyms: 4-bromo-N-{3-[(4-methylphenyl)sulfonyl]-1-(prop-2-en-1-yl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzenesulfonamide
Smiles: C=CCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)Br)S(=O)(=O)c1ccc(cc1)C

STK548378
Synonyms: 2-imino-1,10-dimethyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Smiles: N#Cc1cc2c(n(c1=N)C)nc1n(c2=O)cccc1C

STK548379
Synonyms: 1-methoxypropan-2-yl2-amino-1-(2-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCC(OC(=O)c1c2nc3ccccc3nc2n(c1N)Cc1ccccc1OC)C

STK548381
Synonyms: 9-(butylsulfanyl)-8-(2-methylprop-2-en-1-yl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCc1c3cccc1

STK548382
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(2-chlorobenzyl)oxy]phenyl}methylidene]-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CN1CCc2c1cccc2)C(=O)N/N=C/c1cccc(c1)OCc1ccccc1Cl

STK548383
Synonyms: 5-(2,4-dimethoxyphenyl)-3-hydroxy-1-(4-nitrophenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(c(c1)OC)C1C(=C(C(=O)N1c1ccc(cc1)[N+](=O)[O-])O)C(=O)c1ccccc1

STK548384
Synonyms: 5-iodo-N-(2,2,6,6-tetramethylpiperidin-4-yl)furan-2-carboxamide
Smiles: O=C(c1ccc(o1)I)NC1CC(C)(C)NC(C1)(C)C

STK548385
Synonyms: ethyl2-{[(3-amino-5-oxo-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-2-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCC2)NC(=O)c1sc2c(c1N)cc1c(n2)CCCC1=O

STK548386
Synonyms: (2E)-2-(1,3-benzothiazol-2(3H)-ylidene)-4-(1,3-benzoxazol-2-ylsulfanyl)-3-oxobutanenitrile
Smiles: N#C/C(=c/1\sc2c([nH]1)cccc2)/C(=O)CSc1nc2c(o1)cccc2

STK548387
Synonyms: (8S,8aR,11aS)-10-(naphthalen-2-yl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1N=Cc1c2cccc1)c1ccc2c(c1)cccc2)c1ccccc1

STK548388
Synonyms: 3-[2-(4-fluorophenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1)F

STK548389
Synonyms: 2-benzyl-1-(3,4-dimethoxybenzyl)-1H-benzimidazole
Smiles: COc1cc(ccc1OC)Cn1c(Cc2ccccc2)nc2c1cccc2

STK548390
Synonyms: 2-{[3-cyano-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-(4-fluorobenzyl)acetamide
Smiles: N#Cc1c(SCC(=O)NCc2ccc(cc2)F)nc(cc1C(F)(F)F)c1cccs1

STK548391
Synonyms: ethyl4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate
Smiles: CCCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C(=O)OCC)C#N

STK548392
Synonyms: 3-bromo-1,7-bis(bromomethyl)-7-methylbicyclo[2.2.1]heptan-2-one
Smiles: BrCC12CCC(C2(C)CBr)C(C1=O)Br

STK548393
Synonyms: 7-tert-butyl-2-(ethylsulfanyl)-3-(3-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCC(C3)C(C)(C)C

STK548394
Synonyms: 8-(2-methylprop-2-en-1-yl)-9-[(2-oxo-2-phenylethyl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CC(=C)Cn1c(SCC(=O)c2ccccc2)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK548395
Synonyms: N'-[(3Z)-2-oxo-1-(prop-2-yn-1-yl)-1,2-dihydro-3H-indol-3-ylidene]pyridine-4-carbohydrazide
Smiles: C#CCN1c2ccccc2/C(=N/NC(=O)c2ccncc2)/C1=O

STK548396
Synonyms: (2'S,3'R)-2'-(2,4-dichlorophenyl)-3'-(phenylcarbonyl)-2',3'-dihydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-1,3-dione
Smiles: Clc1ccc(c(c1)Cl)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

STK548397
Synonyms: 8-{[bis(2-methoxyethyl)amino]methyl}-3-(3,5-dimethylphenoxy)-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: COCCN(Cc1c(O)ccc2c1oc(c(c2=O)Oc1cc(C)cc(c1)C)C(F)(F)F)CCOC

STK548398
Synonyms: 4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-methoxyphenylbenzoate
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc1OC(=O)c1ccccc1

STK548400
Synonyms: 2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK548401
Synonyms: N-{2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1sc2c(c1C#N)CCCC2

STK548402
Synonyms: 4-{6-[(3,5-dimethylphenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}-2-methoxyphenol
Smiles: COc1cc(ccc1O)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cc(C)cc(c1)C)nc1c2cccc1

STK548404
Synonyms: 3-[(3-methylbutyl)sulfanyl]-5-phenyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CC(CCSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1)C

STK548405
Synonyms: ethyl4-(2-hydroxynaphthalen-1-yl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(C)N(C)C(=O)NC1c1c(O)ccc2c1cccc2

STK548406
Synonyms: N-({2-[(5-chloro-2-methoxyphenyl)carbonyl]hydrazinyl}carbonothioyl)-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
Smiles: COc1ccc(cc1C(=O)NNC(=S)NC(=O)c1c(C)onc1c1c(Cl)cccc1Cl)Cl

STK548407
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-8-methoxy-N-methyl-5H-pyrimido[5,4-b]indol-4-amine
Smiles: COc1ccc2c(c1)c1ncnc(c1[nH]2)N(CCc1ccc(c(c1)OC)OC)C

STK548408
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperazin-1-yl)methyl]-N'-{(1E)-1-[3-(2H-tetrazol-2-yl)phenyl]ethylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1cccc(c1)n1nncn1)\C

STK548410
Synonyms: 1-benzyl-3-(4-benzylpiperazin-1-yl)-4-chloro-1H-pyrrole-2,5-dione
Smiles: ClC1=C(N2CCN(CC2)Cc2ccccc2)C(=O)N(C1=O)Cc1ccccc1

STK548411
Synonyms: 3-amino-N-(2-ethoxyphenyl)-6-ethyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: CCOc1ccccc1NC(=O)c1sc2c(c1N)cc1c(n2)CCC(C1)CC

STK548414
Synonyms: [3-(4-benzylpiperidin-1-yl)quinoxalin-2-yl][(4-methylphenyl)sulfonyl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCC(CC1)Cc1ccccc1

STK548416
Synonyms: ethyl2-({[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc3CCCCCc3cc2C#N)sc2c1CCC2

STK548417
Synonyms: 2-(benzylsulfanyl)-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCn1c(SCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548418
Synonyms: 4-amino-N'-[(1E)-1-(1,3-benzodioxol-5-yl)ethylidene]-1,2,5-oxadiazole-3-carbohydrazonamide
Smiles: C/C(=N\N=C(\c1nonc1N)/N)/c1ccc2c(c1)OCO2

STK548419
Synonyms: (4-chlorophenyl)[4-(6-nitro-4-phenylquinazolin-2-yl)piperazin-1-yl]methanone
Smiles: Clc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2ccc(cc2c(n1)c1ccccc1)[N+](=O)[O-]

STK548420
Synonyms: 4-nitro-5-(quinolin-5-ylamino)benzene-1,2-dicarbonitrile
Smiles: N#Cc1cc(Nc2cccc3c2cccn3)c(cc1C#N)[N+](=O)[O-]

STK548422
Synonyms: N'-[(3E)-2-oxo-1-(prop-2-yn-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-2-phenylacetohydrazide
Smiles: C#CCN1c2ccccc2/C(=N\NC(=O)Cc2ccccc2)/C1=O

STK548424
Synonyms: (3Z)-1-(2-bromoethyl)-3-[2-(quinolin-2-yl)hydrazinylidene]-1,3-dihydro-2H-indol-2-one
Smiles: BrCCN1C(=O)/C(=N\Nc2ccc3c(n2)cccc3)/c2c1cccc2

STK548426
Synonyms: 5-amino-1-phenyl-6-(propylsulfanyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Smiles: CCCSc1nc2n(ncc2c(=O)n1N)c1ccccc1

STK548427
Synonyms: 1-(3-{[(4-bromophenyl)sulfonyl]amino}-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperidine-4-carboxamide
Smiles: Brc1ccc(cc1)S(=O)(=O)NC1=C(N2CCC(CC2)C(=O)N)C(=O)c2c(C1=O)cccc2

STK548429
Synonyms: 11-benzyl-3-(4-ethoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCOc1ccc(cc1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1

STK548430
Synonyms: 11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-3-(4-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)C

STK548431
Synonyms: 6,6'-[(4-nitrophenyl)methanediyl]bis(7-hydroxy-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one)
Smiles: Oc1nc2SCCn2c(=O)c1[C@H](c1c(O)nc2n(c1=O)CCS2)c1ccc(cc1)[N+](=O)[O-]

STK548432
Synonyms: 2,2-dichloro-N-(4-chloropyridin-2-yl)-1-phenylcyclopropanecarboxamide
Smiles: Clc1ccnc(c1)NC(=O)C1(CC1(Cl)Cl)c1ccccc1

STK548433
Synonyms: 2-{[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-6-methyl-4-(thiophen-3-yl)-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile
Smiles: N#Cc1c(SCC(=O)N2CCc3c(C2)cc(c(c3)OC)OC)nc2c(c1c1cscc1)CN(CC2)C

STK548434
Synonyms: N-[1-(1-benzyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-tert-butylbenzamide
Smiles: CSCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)c1ccc(cc1)C(C)(C)C

STK548435
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-chlorophenyl)carbonyl]-2-(4-methylphenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=CC(=C1)C(=O)c1ccccc1

STK548437
Synonyms: N'-[(E)-(2-hydroxyphenyl)methylidene]-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetohydrazide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1ccccc1O

STK548438
Synonyms: ethyl4-[3-hydroxy-5-(2-nitrophenyl)-2-oxo-4-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)c1ccccc1)O

STK548439
Synonyms: 2-amino-1-(3,5-dimethylphenyl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccccc1NC(=O)c1c2nc3ccccc3nc2n(c1N)c1cc(C)cc(c1)C

STK548440
Synonyms: (5E)-1-benzyl-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/NCCCn1ccnc1)Cc1ccccc1

STK548441
Synonyms: N-[1-(1H-benzimidazol-2-yl)butyl]furan-2-carboxamide
Smiles: CCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccco1

STK548442
Synonyms: phenyl(4-methyl-2-{[(4-methylphenyl)sulfonyl]amino}-1,3-thiazol-5-yl)carbamate
Smiles: O=C(Nc1sc(nc1C)NS(=O)(=O)c1ccc(cc1)C)Oc1ccccc1

STK548444
Synonyms: 5-ethyl-3,10,10-trimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCc1nc2sc3c(c2c2n1c(C)nn2)CC(OC3)(C)C

STK548445
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(2-fluorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2N=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1F)cccc3

STK548447
Synonyms: 4-[4-(4-methylbenzyl)piperazin-1-yl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: Cc1ccc(cc1)CN1CCN(CC1)c1ncnc2c1c1CCCCc1s2

STK548449
Synonyms: 3-[3-(2-iodophenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccccc1I

STK548450
Synonyms: 4-[(1E)-1-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(morpholin-4-ylmethyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]-2-methoxyphenyl4-chlorobenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)Cl)/C(=N/NC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N)/C

STK548451
Synonyms: 4-amino-N'-{(E)-[3-bromo-5-ethoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylidene}-1,2,5-oxadiazole-3-carbohydrazonamide
Smiles: CCOc1cc(/C=N/N=C(/c2nonc2N)\N)cc(c1OCc1cccc2c1cccc2)Br

STK548452
Synonyms: (5Z)-3-(3-chloro-4-methylbenzyl)-5-(2,3-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cccc(c1OC)/C=C/1\SC(=S)N(C1=O)Cc1ccc(c(c1)Cl)C

STK548453
Synonyms: 1-[1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-3-phenylurea
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)Nc1ccccc1

STK548454
Synonyms: 2,4-dichloro-N-(2-{(2Z)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccc(cc2Cl)Cl)/c2c1cccc2

STK548455
Synonyms: 3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(C)c(c(c1)C)Cl

STK548456
Synonyms: (4R,4aR)-2-amino-4-(2,5-dimethoxyphenyl)-6-methyl-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCC(C2)C)c1cc(OC)ccc1OC)(C#N)C#N

STK548457
Synonyms: 2-(4-methoxyphenyl)-3-[3-(naphthalen-1-yloxy)propyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cccc2c1cccc2

STK548458
Synonyms: 3-butyl-2-[(2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCn1c(SCCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548460
Synonyms: pentyl4-[(6-bromoquinazolin-4-yl)amino]benzoate
Smiles: CCCCCOC(=O)c1ccc(cc1)Nc1ncnc2c1cc(Br)cc2

STK548461
Synonyms: 2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N,N-diethylacetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3)CC

STK548462
Synonyms: diethyl5-({(2E)-2-cyano-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}amino)-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C(=C/c2ccc(cc2)C(C)C)/C#N)sc(c1C)C(=O)OCC

STK548464
Synonyms: 2,6-dimethoxy-N-[(2-methoxydibenzo[b,d]furan-3-yl)carbamothioyl]benzamide
Smiles: COc1cc2c(cc1NC(=S)NC(=O)c1c(OC)cccc1OC)oc1c2cccc1

STK548465
Synonyms: 3-[2-(2,4-dimethylphenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1C)C

STK548466
Synonyms: methyl4-{6-[(3-chlorophenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cccc(c1)Cl)nc1c2cccc1

STK548467
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(4-fluorobenzyl)oxy]phenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Fc1ccc(cc1)COc1cccc(c1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK548468
Synonyms: 4-amino-N'-[(E)-{3-[(2-chlorobenzyl)oxy]phenyl}methylidene]-1,2,5-oxadiazole-3-carbohydrazonamide
Smiles: Clc1ccccc1COc1cccc(c1)/C=N/N=C(/c1nonc1N)\N

STK548469
Synonyms: ethyl2-[(3-{[(4-fluorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(cc2)F)sc(c1C)C

STK548470
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-5-methoxy-4-[(2-methylbenzyl)oxy]phenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1OCc1ccccc1C)Br

STK548472
Synonyms: 5-(4-tert-butylphenyl)-1-(3-chlorophenyl)-3-[(3-chlorophenyl)amino]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1cccc(c1)N1C(=O)C(=CC1c1ccc(cc1)C(C)(C)C)Nc1cccc(c1)Cl

STK548473
Synonyms: 3-amino-N-(2,6-dimethylphenyl)-4-(4-methoxyphenyl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1ccc(cc1)c1cc(nc2c1c(N)c(s2)C(=O)Nc1c(C)cccc1C)c1cccs1

STK548474
Synonyms: N-(4-phenylbutan-2-yl)-2-[(5-phenyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Smiles: CC(NC(=O)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1)CCc1ccccc1

STK548475
Synonyms: 2-(4-methoxyphenyl)-3-{3-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]propyl}quinazolin-4(3H)-one
Smiles: C=CCc1ccc(c(c1)OC)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK548476
Synonyms: 2-(4-chlorophenyl)-3-[5-(2-methoxy-4-methylphenoxy)pentyl]quinazolin-4(3H)-one
Smiles: COc1cc(C)ccc1OCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK548477
Synonyms: methyl5-(4-nitrophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: COC(=O)C1=NNC2C1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-]

STK548478
Synonyms: propan-2-yl2-amino-1-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CC(OC(=O)c1c2nc3ccccc3nc2n(c1N)CCc1ccccc1)C

STK548479
Synonyms: N-{1-(3-butoxypropyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzenesulfonamide
Smiles: CCCCOCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)C

STK548480
Synonyms: 5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-1,3-bis(2-methoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccccc1N1C(=O)/C(=C/Nc2c(C)n(n(c2=O)c2ccccc2)C)/C(=O)N(C1=S)c1ccccc1OC

STK548481
Synonyms: 2-[(6,6-dimethyl-2-phenyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK548482
Synonyms: [(4-bromophenyl)sulfonyl]{1,4-dioxo-3-[1-(propan-2-yl)-1H-imidazol-3-ium-3-yl]-1,4-dihydronaphthalen-2-yl}azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccn(c2)C(C)C)C(=O)c2c(C1=O)cccc2

STK548483
Synonyms: 1-benzyl-4-[(4-chlorophenyl)carbonyl]-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])Cc1ccccc1

STK548484
Synonyms: N-[1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-bromobenzamide
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccc(cc1)Br

STK548485
Synonyms: 1-(9H-carbazol-9-yl)-3-[4-(4-chlorobenzyl)piperazin-1-yl]propan-2-ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)CN1CCN(CC1)Cc1ccc(cc1)Cl

STK548486
Synonyms: ethyl4-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)NC1c1cn(nc1c1ccc(c(c1)[N+](=O)[O-])OCC)c1ccccc1

STK548487
Synonyms: 1-[4-(4-ethylphenyl)-3'-(4-nitrophenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone
Smiles: CCc1ccc(cc1)C1=NN(c2ccccc2)C2(c3c1cccc3)SC(=NN2c1ccc(cc1)[N+](=O)[O-])C(=O)C

STK548488
Synonyms: 1-methoxypropan-2-yl2-amino-1-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)OC)C

STK548489
Synonyms: N-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1,4-dioxo-1,4-dihydronaphthalen-2-yl}benzenesulfonamide
Smiles: O=C1C(=C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)C(=O)c2c1cccc2)NS(=O)(=O)c1ccccc1

STK548491
Synonyms: 2-{[3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2cc(OC)c(c(c2)OC)OC)c(c(c1)c1cccs1)C#N

STK548492
Synonyms: 3,4-dimethoxy-N-(morpholin-4-ylcarbonothioyl)benzamide
Smiles: COc1cc(ccc1OC)C(=O)NC(=S)N1CCOCC1

STK548495
Synonyms: 11-(3-chloro-4-methoxyphenyl)-3-hexyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)Cl)OC

STK548496
Synonyms: 4-[(4-chlorophenyl)carbonyl]-1-(4-fluorophenyl)-3-hydroxy-5-(2-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccccc1C1C(=C(C(=O)N1c1ccc(cc1)F)O)C(=O)c1ccc(cc1)Cl

STK548497
Synonyms: N-(2,4-dimethoxyphenyl)-11-(4-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)F)c(nn1c1ccccc1)C

STK548498
Synonyms: N,N,4-tributyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
Smiles: CCCCN(c1ncnc2c1sc1c2c2CCCc2c(n1)CCCC)CCCC

STK548499
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(2-chlorobenzyl)oxy]phenyl}methylidene]-5-(morpholin-4-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/c1ccc(cc1)OCc1ccccc1Cl

STK548500
Synonyms: methyl3-[(2-bromohexanoyl)amino]-5-chloro-1H-indole-2-carboxylate
Smiles: CCCCC(C(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC)Br

STK548502
Synonyms: N-{[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinyl]carbonothioyl}pyridine-3-carboxamide
Smiles: S=C(NC(=O)c1cccnc1)NNC(=O)c1ccc2c(c1)OCO2

STK548503
Synonyms: N'-[(E)-(2,6-dichlorophenyl)methylidene]-4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzohydrazide
Smiles: O=C(c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1c(Cl)cccc1Cl

STK548504
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-cyclohex-3-en-1-ylmethylidene]-5-(morpholin-4-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/C1CCC=CC1

STK548505
Synonyms: (1Z)-N'-{[(4-bromo-3-methylphenoxy)acetyl]oxy}-2-(4-chlorophenyl)ethanimidamide
Smiles: O=C(O/N=C(/Cc1ccc(cc1)Cl)\N)COc1ccc(c(c1)C)Br

STK548509
Synonyms: 7-methyl-2-{[4-(propan-2-yloxy)benzyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Smiles: CC1CCc2c(C1)sc1c2c(N)nc(n1)SCc1ccc(cc1)OC(C)C

STK548510
Synonyms: 5-(3-nitrophenyl)-2,3,3a-triphenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)C2(C1ON(C2c1ccccc1)c1ccccc1)c1ccccc1

STK548511
Synonyms: 2-amino-1-(4-chlorophenyl)-N-hexyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Cl

STK548513
Synonyms: N'~1~,N'~8~-bis[(3Z)-5-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene]octanedihydrazide
Smiles: COc1ccc2c(c1)/C(=N/NC(=O)CCCCCCC(=O)N/N=C/1\C(=O)Nc3c1cc(OC)cc3)/C(=O)N2

STK548514
Synonyms: (5E)-5-(4-butoxybenzylidene)-2-[4-(2-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: CCCCOc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1[N+](=O)[O-]

STK548515
Synonyms: (2E)-N-({4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}carbamothioyl)-3-phenylprop-2-enamide
Smiles: CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccccc1

STK548517
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-ethoxy-4-[(2-methylbenzyl)oxy]phenyl}methylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCc1ccccc1C

STK548518
Synonyms: [(5-bromothiophen-2-yl)sulfonyl]{3-[4-(3-phenylpropyl)pyridinium-1-yl]quinoxalin-2-yl}azanide
Smiles: Brc1ccc(s1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)CCCc1ccccc1

STK548519
Synonyms: 3-hexyl-11-[2-(4-methoxyphenyl)ethyl]-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2CCc1ccc(cc1)OC

STK548521
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-ethoxy-4-[(3-fluorobenzyl)oxy]phenyl}methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)ccc1OCc1cccc(c1)F

STK548522
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}-5-[(diethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(c(c1)OC)OCc1ccccc1)CC

STK548523
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1Z)-1-(2-chlorophenyl)ethylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccccc1/C(=N\NC(=O)c1nnn(c1c1ccccc1)c1nonc1N)/C

STK548524
Synonyms: 4-[(4-chlorophenyl)carbonyl]-3-hydroxy-5-(3-nitrophenyl)-1-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK548525
Synonyms: 11-(3-chloro-4-methoxyphenyl)-3-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)Cl)OC

STK548526
Synonyms: 3-benzyl-11-(3-chlorophenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Clc1cccc(c1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)Cc1ccccc1

STK548527
Synonyms: 3-(2,5-dibromophenyl)-2-[(E)-2-(2-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Brc1ccc(c(c1)n1c(/C=C/c2ccccc2[N+](=O)[O-])nc2c(c1=O)cccc2)Br

STK548528
Synonyms: N-[4-(4,4-dimethyl-3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)benzyl]-4-methylaniline
Smiles: Cc1ccc(cc1)NCc1ccc(cc1)N1N=C(C(C1c1ccccc1)(C)C)c1ccccc1

STK548529
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(4-chloro-3,5-dimethylphenoxy)methyl]-4-methoxyphenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1COc1cc(C)c(c(c1)C)Cl)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK548530
Synonyms: prop-2-en-1-yl2-amino-1-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)OC

STK548531
Synonyms: N'-(6-chloro-4-phenylquinazolin-2-yl)furan-2-carbohydrazide
Smiles: Clc1ccc2c(c1)c(nc(n2)NNC(=O)c1ccco1)c1ccccc1

STK548532
Synonyms: 2-amino-N-(2,5-dimethylphenyl)-1-(3-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1ccc(c(c1)NC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C)C

STK548533
Synonyms: N-[3-(4-benzylpiperidin-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]-4-bromobenzenesulfonamide
Smiles: Brc1ccc(cc1)S(=O)(=O)NC1=C(N2CCC(CC2)Cc2ccccc2)C(=O)c2c(C1=O)cccc2

STK548534
Synonyms: 3-{[butyl(methyl)amino]methyl}-2,6,8-trimethylquinolin-4-ol
Smiles: CCCCN(Cc1c(C)nc2c(c1O)cc(cc2C)C)C

STK548535
Synonyms: 3-{4-(4-ethoxyphenyl)-5-[(2-fluorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CCOc1ccc(cc1)n1c(SCc2ccccc2F)nnc1c1cccnc1

STK548537
Synonyms: N,4-dimethyl-N-{4-oxo-4-[4-(pyridin-2-yl)piperazin-1-yl]butyl}benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(CCCC(=O)N1CCN(CC1)c1ccccn1)C

STK548538
Synonyms: 3-butyl-11-(3-chloro-4-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)Cl)OC

STK548539
Synonyms: N-(2,4-dimethylphenyl)-2-{[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

STK548540
Synonyms: 3-hydroxy-4-(phenylcarbonyl)-5-[4-(propan-2-yl)phenyl]-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: C=CCN1C(c2ccc(cc2)C(C)C)C(=C(C1=O)O)C(=O)c1ccccc1

STK548541
Synonyms: [(4-methylphenyl)sulfonyl][3-(4-methylpiperazin-1-yl)quinoxalin-2-yl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCN(CC1)C

STK548542
Synonyms: 3-chloro-4-[(4-methoxyphenyl)amino]-1-(naphthalen-1-yl)-1H-pyrrole-2,5-dione
Smiles: COc1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)c1cccc2c1cccc2

STK548544
Synonyms: 2-chloro-N-(2-{(2Z)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccccc2Cl)/c2c1cccc2

STK548545
Synonyms: 2-{[1-(4-chlorobenzyl)-1H-benzimidazol-2-yl]sulfanyl}-N'-[(E)-1H-indol-3-ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nc2c(n1Cc1ccc(cc1)Cl)cccc2)N/N=C/c1c[nH]c2c1cccc2

STK548546
Synonyms: N,N-diethyl-2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)N(CC)CC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548547
Synonyms: 2-methoxyethyl2-amino-1-(4-butylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)OCCOC

STK548548
Synonyms: (3aR,4S,9aR,9bS)-2-(4-chlorophenyl)-4-[(4-chlorophenyl)carbonyl]-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)Cl)C(=O)c1ccccc1

STK548549
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-chlorophenyl)carbonyl]-2-(4-fluorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=CC(=C1)C(=O)c1ccccc1

STK548550
Synonyms: methyl2-amino-1-(2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1OC)OC

STK548551
Synonyms: 3-{[(E)-(2-hydroxy-6-nitronaphthalen-1-yl)methylidene]amino}-2-propylquinazolin-4(3H)-one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1c(O)ccc2c1ccc(c2)[N+](=O)[O-]

STK548552
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylidene}-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCN(CC2)C)c2nonc2N)ccc1OCc1cccc2c1cccc2

STK548554
Synonyms: 4-[(5Z)-5-(1H-indol-3-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoicacid
Smiles: S=C1S/C(=C\c2c[nH]c3c2cccc3)/C(=O)N1c1ccc(cc1)C(=O)O

STK548555
Synonyms: N-ethyl-2-imino-10-methyl-1-(4-methylbenzyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: CCNC(=O)c1cc2c(n(c1=N)Cc1ccc(cc1)C)nc1n(c2=O)cccc1C

STK548556
Synonyms: 4-{2-[(2E)-2-(2-hydroxybenzylidene)hydrazinyl]-2-oxoethoxy}-N'-[(E)-(2-hydroxyphenyl)methylidene]benzohydrazide
Smiles: O=C(COc1ccc(cc1)C(=O)N/N=C/c1ccccc1O)N/N=C/c1ccccc1O

STK548557
Synonyms: [3-(3-{[(4-chlorophenyl)carbonyl]amino}pyridinium-1-yl)quinoxalin-2-yl](phenylsulfonyl)azanide
Smiles: Clc1ccc(cc1)C(=O)Nc1ccc[n+](c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1

STK548558
Synonyms: 3-(hexylsulfanyl)-5-phenyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCCCCCSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK548560
Synonyms: 3-[3-(2,6-dimethoxyphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(OC)cccc1OC

STK548561
Synonyms: 9-[(3-methylbutyl)sulfanyl]-8-(2-methylprop-2-en-1-yl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CC(=C)Cn1c(SCCC(C)C)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK548562
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc(c1OC)OC

STK548563
Synonyms: N-[1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-3-fluoro-N-[2-(4-methoxyphenyl)ethyl]benzamide
Smiles: COc1ccc(cc1)CCN(C(=O)c1cccc(c1)F)C1CC(=O)N(C1=O)c1ccc(cc1)Cl

STK548565
Synonyms: (2E)-3-(4-bromophenyl)-N-({4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}carbamothioyl)prop-2-enamide
Smiles: S=C(Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C)NC(=O)/C=C/c1ccc(cc1)Br

STK548566
Synonyms: 2'-(biphenyl-4-yl)-2,2-dimethyl-1',2,3,5,6,10b'-hexahydrospiro[pyran-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: CC1(C)OCCC2(C1)Oc1ccccc1C1N2N=C(C1)c1ccc(cc1)c1ccccc1

STK548567
Synonyms: 2-{[6-amino-4-(2-chlorophenyl)-3,5-dicyanopyridin-2-yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)N)nc(c(c1c1ccccc1Cl)C#N)N

STK548568
Synonyms: 2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N,N-diphenylacetamide
Smiles: CCCn1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548569
Synonyms: 2-[(E)-2-(4-nitrophenyl)ethenyl]-3-(pyridin-4-yl)quinazolin-4(3H)-one
Smiles: O=c1n(c2ccncc2)c(/C=C/c2ccc(cc2)[N+](=O)[O-])nc2c1cccc2

STK548570
Synonyms: (8S,8aR,11aS)-8-[(4-methoxyphenyl)carbonyl]-10-(4-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])cccc3

STK548571
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(naphthalen-2-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1N=Cc1c2cccc1)c1ccc2c(c1)cccc2

STK548572
Synonyms: ethyl6-bromo-4-[(5-hydroxypentyl)amino]quinoline-3-carboxylate
Smiles: OCCCCCNc1c(cnc2c1cc(Br)cc2)C(=O)OCC

STK548573
Synonyms: N-ethyl-1-(2-hydroxyethyl)-2-imino-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: OCCn1c(=N)c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCC

STK548575
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-4-[(2-fluorobenzyl)oxy]-5-methoxyphenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1OCc1ccccc1F)Br

STK548576
Synonyms: ethyl6-methyl-2-({[(3,4,5-trimethoxyphenyl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2cc(OC)c(c(c2)OC)OC)sc2c1CCC(C2)C

STK548577
Synonyms: 3-amino-N-(2,5-dichlorophenyl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: Clc1ccc(c(c1)NC(=O)c1sc2c(c1N)ccc(n2)c1cccs1)Cl

STK548578
Synonyms: 3-[4-(decyloxy)phenyl]-1-[(2,6-difluorobenzyl)oxy]quinoxalin-2(1H)-one4-oxide
Smiles: CCCCCCCCCCOc1ccc(cc1)c1c(=O)n(OCc2c(F)cccc2F)c2c([n+]1[O-])cccc2

STK548580
Synonyms: 3-[(Z)-(3-cyclopentyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(4-ethylpiperazin-1-yl)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCC1

STK548581
Synonyms: N,N-dibutyl-2-{[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)OC)CCCCC3)CCCC

STK548582
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-5-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}methylidene]-5-(phenoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)cc(c1OCc1ccc(cc1)F)Br

STK548583
Synonyms: 3-[2-(2,4-dichlorophenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1Cl)Cl

STK548584
Synonyms: 11-(3-chlorophenyl)-3-(3,5-dimethylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Clc1cccc(c1)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK548585
Synonyms: methylcyano[3-(3,5-dimethylpiperidin-1-yl)quinoxalin-2-yl]acetate
Smiles: N#CC(c1nc2ccccc2nc1N1CC(C)CC(C1)C)C(=O)OC

STK548586
Synonyms: methyl2-({(2E)-2-cyano-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}amino)-4,5-dimethylthiophene-3-carboxylate
Smiles: N#C/C(=C\c1ccc(cc1)C(C)C)/C(=O)Nc1sc(c(c1C(=O)OC)C)C

STK548588
Synonyms: ethyl4-{[11-(3-bromophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Br)c(nn1c1ccccc1)C

STK548589
Synonyms: 3-(2-methoxyphenyl)-2-[(3-methylbutyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: COc1ccccc1n1c(SCCC(C)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK548590
Synonyms: (8S,8aR,11aS)-10-(4-butoxyphenyl)-8-[(4-chlorophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: CCCCOc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1C2c2ccccc2C=C1)C(=O)c1ccc(cc1)Cl

STK548591
Synonyms: 2-methoxyethyl2-amino-1-(4-bromophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Br

STK548592
Synonyms: 2-(prop-2-en-1-ylsulfanyl)-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCn1c(SCC=C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548593
Synonyms: 3-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenyl4-chloro-3-nitrobenzoate
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1cccc(c1)OC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STK548594
Synonyms: 2-[(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Smiles: CCCCn1c(SCC(=O)Nc2ccc(cc2)OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548595
Synonyms: (4Z)-2-(furan-2-yl)-4-(3-methoxy-4-propoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: CCCOc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1ccco1

STK548596
Synonyms: N-(3-chloro-4-fluorophenyl)-11-(2-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)F)c1ccccc1

STK548598
Synonyms: N-(4-bromophenyl)-2-[(5-ethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)Br)nn2)CCCC3

STK548599
Synonyms: 4-[(4-chlorophenyl)carbonyl]-3-hydroxy-5-phenyl-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: C=CCN1C(c2ccccc2)C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK548600
Synonyms: 8-(4-methylphenyl)-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione
Smiles: O=C1NC(=O)C2C1C(c1ccc(cc1)C)c1c(S2)[nH]c(=O)s1

STK548601
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-ethylphenyl)methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK548602
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(3,5-dichlorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2N=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl)cccc3

STK548603
Synonyms: 8-(2-methylprop-2-en-1-yl)-9-[(2-phenylethyl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CC(=C)Cn1c(SCCc2ccccc2)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK548604
Synonyms: N'-{[1,3-bis(2-methoxyphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-hydroxybenzohydrazide
Smiles: COc1ccccc1N1C(=O)/C(=C/NNC(=O)c2ccccc2O)/C(=O)N(C1=S)c1ccccc1OC

STK548605
Synonyms: 1-[1-(3-chlorophenyl)-8-(4-chlorophenyl)-6-phenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7-dien-3-yl]ethanone
Smiles: Clc1ccc(cc1)C1=NN(C2(CC1)SC(=NN2c1cccc(c1)Cl)C(=O)C)c1ccccc1

STK548606
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)cc(c1OCc1ccc(cc1)F)Br

STK548607
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)ccc1OC

STK548608
Synonyms: 3-[2-(3,4-dimethylphenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(c(c1)C)C

STK548609
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-{(E)-[5-(4-nitrophenyl)furan-2-yl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C)c1nonc1N)N/N=C/c1ccc(o1)c1ccc(cc1)[N+](=O)[O-]

STK548610
Synonyms: 3-tert-butyl-7-{[2-(4-methylpiperidin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: CC1CCN(CC1)CCNc1cc2oc3cc(ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1)C(C)(C)C

STK548612
Synonyms: 3-[3-(4-chlorophenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1)Cl

STK548613
Synonyms: 6-amino-3-(propan-2-yl)-4-[2-(trifluoromethyl)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1C(F)(F)F)c([nH]n2)C(C)C

STK548614
Synonyms: [3-(3,5-dimethylpyridinium-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl](thiophen-2-ylsulfonyl)azanide
Smiles: Cc1cc(C)c[n+](c1)C1=C([N-]S(=O)(=O)c2cccs2)C(=O)c2c(C1=O)cccc2

STK548615
Synonyms: (1'R,2'R)-1'-[(4-chlorophenyl)carbonyl]-2'-(3,4-dimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(cc1OC)[C@H]1[C@H](C(=O)c2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

STK548616
Synonyms: 2-{[6-iodo-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)cc(cc2)I

STK548617
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(2,4-dichlorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Cl)Cl)cccc3

STK548618
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-tert-butylphenyl)methylidene]-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1ccc(cc1)C(C)(C)C

STK548620
Synonyms: 3-[3-(3,5-dimethylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(C)cc(c1)C

STK548621
Synonyms: 3-[3-(4-methoxyphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK548623
Synonyms: N-cyclohexyl-1-(furan-2-ylmethyl)-2-{[(4-nitrophenyl)sulfonyl]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: [O-][N+](=O)c1ccc(cc1)S(=O)(=O)Nc1c(C(=O)NC2CCCCC2)c2c(n1Cc1ccco1)nc1c(n2)cccc1

STK548624
Synonyms: 2-imino-1-methyl-3-(phenylsulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Smiles: O=c1c2cc(c(=N)n(c2nc2n1cccc2)C)S(=O)(=O)c1ccccc1

STK548625
Synonyms: (4Z)-2-phenyl-4-[(1,3-thiazol-2-ylamino)methylidene]-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\Nc1nccs1)c1ccccc1

STK548626
Synonyms: 3-[3-(2-chloro-4,6-dimethylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)cc(cc1Cl)C

STK548627
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-methoxyphenyl)ethylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CN1CCC(CC1)C)c1nonc1N)/C

STK548628
Synonyms: N-(4-bromophenyl)-2-({5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK548632
Synonyms: [(4-chlorophenyl)sulfonyl](3-{4-[(thiophen-2-ylcarbonyl)amino]pyridinium-1-yl}quinoxalin-2-yl)azanide
Smiles: Clc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)NC(=O)c1cccs1

STK548633
Synonyms: 2-(4-methoxyphenyl)-3-{3-[5-methyl-2-(propan-2-yl)phenoxy]propyl}quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(C)ccc1C(C)C

STK548634
Synonyms: 3-{4-(4-bromophenyl)-5-[(4-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK548635
Synonyms: (8S,8aR,11aS)-8-[(4-methoxyphenyl)carbonyl]-10-(2-methyl-4-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-])cccc3

STK548637
Synonyms: 2-(2-cyanoethyl)-3-methyl-1-(morpholin-4-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#CCCc1c(C)c(C#N)c2n(c1N1CCOCC1)c1ccccc1n2

STK548638
Synonyms: 7-(4-bromophenyl)-N,N-diethyl-7H-chromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-3-amine
Smiles: CCN(c1ccc2c(c1)OC1=NC(n3c(C1=C2)nc1c3cccc1)c1ccc(cc1)Br)CC

STK548639
Synonyms: 2-{[4-oxo-3-(2-phenylethyl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N,N-dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3)CCC

STK548641
Synonyms: 3-{4-(4-bromophenyl)-5-[(4-fluorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Fc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK548642
Synonyms: (8S,8aR,11aS)-10-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)cccc3

STK548643
Synonyms: (2E)-N-({4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl}carbamothioyl)-3-(4-methylphenyl)prop-2-enamide
Smiles: COc1ncnc(c1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)C

STK548644
Synonyms: (8S,8aR,11aS)-8-(phenylcarbonyl)-10-[2-(trifluoromethyl)phenyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: O=C([C@H]1N2N=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)cccc3)c1ccccc1

STK548646
Synonyms: 2-{[3-cyano-4-(4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]sulfanyl}-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Smiles: COc1ccc(cc1)c1c(C#N)c(SCC(=O)Nc2sc3c(c2C#N)CCCC3)nc2c1CCC2

STK548647
Synonyms: 2-[(4-amino-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide
Smiles: CC1CCc2c(C1)sc1c2c(N)nc(n1)SCC(=O)Nc1ccc(cc1)C

STK548648
Synonyms: N-[2-(1H-benzimidazol-2-yl)propan-2-yl]-2-methylbenzamide
Smiles: Cc1ccccc1C(=O)NC(c1nc2c([nH]1)cccc2)(C)C

STK548649
Synonyms: (9E)-9-(2,4-dichlorobenzylidene)-5-(2,4-dichlorophenyl)-3-phenyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: Clc1ccc(c(c1)Cl)C1C2=C(N=c3n1c(cs3)c1ccccc1)/C(=C/c1ccc(cc1Cl)Cl)/CCC2

STK548651
Synonyms: (6aS,6bR,9aS,10R)-10-[(3-bromo-4-methoxyphenyl)carbonyl]-8-(2,3-dihydro-1,4-benzodioxin-6-yl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc3c(c1)OCCO3)C=Cc1c2cccc1

STK548652
Synonyms: {2-[3-{bis[2-(hydroxy-kappaO)ethyl]amino-kappaN}-2-(hydroxy-kappaO)propoxy]-N-phenylbenzamidato(3-)}boron
Smiles: O=C(c1ccccc1OCC1C[N+]23[B-](O1)(OCC3)OCC2)Nc1ccccc1

STK548653
Synonyms: 3-hydroxy-1-[(4-methylpiperidin-1-yl)methyl]-3-(2-oxo-2-phenylethyl)-1,3-dihydro-2H-indol-2-one
Smiles: CC1CCN(CC1)CN1c2ccccc2C(C1=O)(O)CC(=O)c1ccccc1

STK548654
Synonyms: (3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(4-nitrophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccccc1

STK548657
Synonyms: methyl{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}(cyano)acetate
Smiles: COC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)C#N

STK548658
Synonyms: ethyl3-{4-cyano-1-[(4-ethoxyphenyl)amino]-3-methylpyrido[1,2-a]benzimidazol-2-yl}propanoate
Smiles: CCOC(=O)CCc1c(C)c(C#N)c2n(c1Nc1ccc(cc1)OCC)c1ccccc1n2

STK548659
Synonyms: 3-{2-[4-(butan-2-yl)phenoxy]ethyl}-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: CCC(c1ccc(cc1)OCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC)C

STK548660
Synonyms: N-[1,1,1,3,3,3-hexafluoro-2-(2-phenylhydrazinyl)propan-2-yl]-2-phenoxyacetamide
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)NNc1ccccc1)COc1ccccc1

STK548662
Synonyms: 1-{(E)-[(2-methoxyphenyl)imino]methyl}-17-(2-nitrophenyl)-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione(non-preferredname)
Smiles: COc1ccccc1/N=C/C12C3C(C(=O)N(C3=O)c3ccccc3[N+](=O)[O-])C(c3c1cccc3)c1c2cccc1

STK548663
Synonyms: N-(3-chlorophenyl)-4-[4-(prop-2-yn-1-yloxy)phenyl]phthalazin-1-amine
Smiles: C#CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1cccc(c1)Cl

STK548665
Synonyms: (4Z)-2-(furan-2-yl)-4-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)c1ccco1

STK548666
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)F)nnc1c1cccnc1

STK548668
Synonyms: 2-methoxyethyl1-(3-acetylphenyl)-2-amino-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(=O)C

STK548670
Synonyms: (8S,8aR,11aS)-10-(1,3-benzodioxol-5-yl)-8-[(3-nitrophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: O=C([C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCO2)cccc3)c1cccc(c1)[N+](=O)[O-]

STK548671
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{2-[(2-chloro-6-fluorobenzyl)oxy]-4-(diethylamino)phenyl}methylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(c1ccc(c(c1)OCc1c(F)cccc1Cl)/C=N/NC(=O)c1nnn(c1CN1CCC(CC1)C)c1nonc1N)CC

STK548672
Synonyms: N-benzyl-2-{[3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)NCc2ccccc2)c(c(c1)c1cccs1)C#N

STK548673
Synonyms: [3-(4-{[(4-chlorophenyl)carbonyl]amino}pyridinium-1-yl)quinoxalin-2-yl][(4-ethoxyphenyl)sulfonyl]azanide
Smiles: CCOc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)NC(=O)c1ccc(cc1)Cl

STK548674
Synonyms: N-(3-chloro-4-methoxyphenyl)-10-methyl-8-phenyl-11-[4-(propan-2-yl)phenyl]-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)C)c(nn1c1ccccc1)C

STK548675
Synonyms: N'-[(E)-(5-chloro-2-hydroxyphenyl)methylidene]-4-[(2,8-dimethylquinolin-4-yl)amino]benzohydrazide
Smiles: Clc1ccc(c(c1)/C=N/NC(=O)c1ccc(cc1)Nc1cc(C)nc2c1cccc2C)O

STK548676
Synonyms: (3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(2-methyl-4-nitrophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-])C(=O)c1ccccc1

STK548677
Synonyms: 3-(4-tert-butylphenyl)-11-(4-fluorophenyl)-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCC(=O)N1c2ccccc2NC2=C(C1c1ccc(cc1)F)C(=O)CC(C2)c1ccc(cc1)C(C)(C)C

STK548678
Synonyms: 3-butyl-11-(3,5-dichlorophenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cc(Cl)cc(c1)Cl

STK548679
Synonyms: (8S,8aR,11aS)-10-(2-chlorophenyl)-8-[(4-chlorophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Cl)cccc3

STK548680
Synonyms: 2-amino-1-(3-methylphenyl)-N-(1-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1cccc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NC(c1ccccc1)C

STK548681
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]methylidene}-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK548682
Synonyms: 2,4-dichlorobenzylN'-cyano-N-propan-2-ylcarbamimidothioate
Smiles: N#C/N=C(/NC(C)C)\SCc1ccc(cc1Cl)Cl

STK548683
Synonyms: 2-{[6-tert-butyl-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2nccs2)nc(cc1C(F)(F)F)C(C)(C)C

STK548684
Synonyms: 3-[3-(2-methoxy-4-methylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1cc(C)ccc1OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK548685
Synonyms: 1-benzyl-2-imino-10-methyl-5-oxo-N-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: Cc1cccn2c1nc1n(Cc3ccccc3)c(=N)c(cc1c2=O)C(=O)NCCc1ccccc1

STK548687
Synonyms: 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-6-iodo-3-(4-methylphenyl)quinazolin-4(3H)-one
Smiles: C/C(=C/CSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)C)I)/Cl

STK548690
Synonyms: N-{2-[3-hydroxy-5-(3-nitrophenyl)-2-oxo-4-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]ethyl}acetamide
Smiles: CC(=O)NCCN1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccccc1

STK548692
Synonyms: 2,8,8-trimethyl-4-(pentyloxy)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCCOc1nc(C)nc2c1sc1c2cc2c(n1)CC(OC2)(C)C

STK548695
Synonyms: N-(3,4-difluorophenyl)-6-methyl-4-[4-(propan-2-yl)phenyl]-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Smiles: S=C1NC(=C(C(N1)c1ccc(cc1)C(C)C)C(=O)Nc1ccc(c(c1)F)F)C

STK548696
Synonyms: methyl5-chloro-3-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1cc(OC)c(c(c1)OC)OC)cc(cc2)Cl

STK548698
Synonyms: (8S,8aR,11aS)-N-(4-chlorophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Smiles: O=C([C@@H]1[C@@H]2C(=O)NC(=O)[C@@H]2C2N1C=Cc1c2cccc1)Nc1ccc(cc1)Cl

STK548699
Synonyms: 2-methyl-7-[(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)amino]-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: Cc1ccc2c(c1)[nH]c1c(o2)cc(c2c1c(=O)c1c(c2=O)cccc1)NCCN1CCN(CC1)c1cccc(c1)C(F)(F)F

STK548700
Synonyms: 2-amino-1-(4-ethoxyphenyl)-N-(3-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1cccc(c1)C

STK548702
Synonyms: 1-(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-2-(4-methylpiperazin-1-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)C)c(n2Cc1ccccc1)C

STK548703
Synonyms: propan-2-yl2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COc1cc(ccc1OC)CCn1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK548704
Synonyms: dimethyl(trichloroacetyl)phosphoramidate
Smiles: COP(=O)(NC(=O)C(Cl)(Cl)Cl)OC

STK548705
Synonyms: 2-[(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide
Smiles: CCCCn1c(SCC(=O)NCCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548707
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-N'-[(E)-{4-[(4-fluorobenzyl)oxy]phenyl}methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Fc1ccc(cc1)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N

STK548709
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(s1)SCc1cccc2c1cccc2

STK548711
Synonyms: N-[4-(acetylamino)phenyl]-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)NC(=O)C

STK548714
Synonyms: 2-{[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N,N-dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3)CCC

STK548716
Synonyms: 2-methyl-7-{[2-(4-methylpiperazin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: CN1CCN(CC1)CCNc1cc2oc3ccc(cc3[nH]c2c2c1c(=O)c1ccccc1c2=O)C

STK548717
Synonyms: 2-({5-[3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(pyridin-3-ylmethyl)acetamide
Smiles: C=CCn1c(CCCn2c(=O)c3cccc4c3c(c2=O)ccc4)nnc1SCC(=O)NCc1cccnc1

STK548718
Synonyms: N'-[(E)-(2,3-dichlorophenyl)methylidene]-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetohydrazide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1cccc(c1Cl)Cl

STK548719
Synonyms: ethyl3-[(diethylamino)methyl]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1CN(CC)CC)cccc2

STK548720
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-chlorophenyl)carbonyl]-2-(2-methyl-5-nitrophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-])C(=O)c1ccccc1

STK548722
Synonyms: N'-[(E)-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}methylidene]-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)Cn2nc(cc2C)[N+](=O)[O-])ccc1OCc1ccc(cc1)F

STK548723
Synonyms: 3-{[3-(morpholin-4-yl)propyl]amino}-1-(4-propoxyphenyl)pyrrolidine-2,5-dione
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)NCCCN1CCOCC1

STK548724
Synonyms: (6aS,6bR,9aS,10R)-10-[(3-bromo-4-methoxyphenyl)carbonyl]-8-(3,5-dichlorophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cc(Cl)cc(c1)Cl)C=Cc1c2cccc1

STK548725
Synonyms: 4-(phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)-8-(2,4-dichlorophenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: O=C([C@H]1[C@@H]2[C@H]([C@H]3N1c1ccccc1C=C3)C(=O)N(C2=O)c1ccc(cc1Cl)Cl)Oc1ccc(cc1)C(=O)c1ccccc1

STK548727
Synonyms: (5E)-2-[4-(4-methylphenyl)piperazin-1-yl]-5-{2-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazol-4(5H)-one
Smiles: Cc1ccc(cc1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccccc2OCc2ccc(cc2)[N+](=O)[O-])/S1

STK548728
Synonyms: 3-(2-bromophenoxy)-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CCC1CCCCN1Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F

STK548729
Synonyms: 2-[(6-amino-3,5-dicyanopyridin-2-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: N#Cc1cc(C#N)c(nc1SCC(=O)Nc1ccc(cc1)OC(F)(F)F)N

STK548731
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-{[3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1c(C#N)c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nc2c1CCCC2

STK548732
Synonyms: 3-(4-bromophenyl)-6-iodo-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4(3H)-one
Smiles: Brc1ccc(cc1)n1c(/C=C/c2ccc(o2)[N+](=O)[O-])nc2c(c1=O)cc(cc2)I

STK548733
Synonyms: 5-(2-acetyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-(3,4-dimethylphenyl)-6-hydroxypyrimidine-2,4(1H,3H)-dione
Smiles: CC(=O)N1CCc2c(C1c1c(O)[nH]c(=O)n(c1=O)c1ccc(c(c1)C)C)cccc2

STK548735
Synonyms: N-(2-{(2Z)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)-2-iodobenzamide(non-preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccccc2I)/c2c1cccc2

STK548738
Synonyms: (1'S,2'S,3S)-2'-[(4-bromophenyl)carbonyl]-N-(4-chlorophenyl)-2-oxo-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinoline]-1'-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@H]1N2c3ccccc3C=CC2[C@@]2([C@@H]1C(=O)c1ccc(cc1)Br)C(=O)Nc1c2cccc1

STK548739
Synonyms: 2-methoxyethyl2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CC(C)C

STK548742
Synonyms: [5-(2-chlorophenyl)furan-2-yl][4-(diphenylmethyl)piperazin-1-yl]methanethione
Smiles: S=C(c1ccc(o1)c1ccccc1Cl)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK548743
Synonyms: 2-{[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(3,4-dichlorobenzyl)acetamide
Smiles: N#Cc1c(SCC(=O)NCc2ccc(c(c2)Cl)Cl)nc(c(c1c1cccs1)C#N)N

STK548744
Synonyms: methyl[6-bromo-2-(2-hydroxy-5-methoxy-3-nitrophenyl)-4-phenyl-1,4-dihydroquinazolin-3(2H)-yl]acetate
Smiles: COC(=O)CN1C(c2ccccc2)c2cc(Br)ccc2NC1c1cc(OC)cc(c1O)[N+](=O)[O-]

STK548745
Synonyms: 3-chloro-4-[(4-chlorophenyl)amino]-1-(2-phenylethyl)-1H-pyrrole-2,5-dione
Smiles: Clc1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)CCc1ccccc1

STK548746
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-4-[(2-fluorobenzyl)oxy]-5-methoxyphenyl}methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)cc(c1OCc1ccccc1F)Br

STK548747
Synonyms: N-(3-methoxyphenyl)-2-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(s1)SCc1cccc2c1cccc2

STK548748
Synonyms: methyl4-{6-[(3-chloro-4-methoxyphenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(c(c1)Cl)OC)nc1c2cccc1

STK548749
Synonyms: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-3-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)CCO)/C1=O

STK548751
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[(3-cyano-5-ethyl-4,6-dimethylpyridin-2-yl)sulfanyl]acetamide
Smiles: N#Cc1c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nc(c(c1C)CC)C

STK548752
Synonyms: 5-phenyl-3-(propylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCCSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK548753
Synonyms: N-[1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]thiophene-2-carboxamide
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)c1cccs1

STK548754
Synonyms: 2-[(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide
Smiles: CCc1nc(SCC(=O)NC(CCc2ccccc2)C)c2c(n1)sc1c2CCCC1

STK548755
Synonyms: 1,1'-piperazine-1,4-diylbis{3-[(1-bromonaphthalen-2-yl)oxy]propan-2-ol}
Smiles: OC(CN1CCN(CC1)CC(COc1ccc2c(c1Br)cccc2)O)COc1ccc2c(c1Br)cccc2

STK548756
Synonyms: 3-(naphthalen-1-yl)-2-phenyltetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazole-1-thione
Smiles: S=C1N2CCCN2C(N1c1ccccc1)c1cccc2c1cccc2

STK548758
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-methoxyphenyl)ethanone
Smiles: COc1cccc(c1)C(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK548760
Synonyms: (5E)-2-[4-(naphthalen-1-yl)piperazin-1-yl]-5-{2-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1cccc2c1cccc2

STK548761
Synonyms: ethyl6-amino-5-cyano-2-{[(4-cyano-1-ethyl-5,6,7,8-tetrahydroisoquinolin-3-yl)methyl]sulfanyl}-4-(3,4-dimethoxyphenyl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(SCc2nc(CC)c3c(c2C#N)CCCC3)OC(=C(C1c1ccc(c(c1)OC)OC)C#N)N

STK548762
Synonyms: ethyl2-({[(3,4,5-trimethoxyphenyl)carbonyl]carbamothioyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2cc(OC)c(c(c2)OC)OC)sc2c1CCCCC2

STK548764
Synonyms: 2-[(4-amino-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N,N-dibutylacetamide
Smiles: CCCCN(C(=O)CSc1nc(N)c2c(n1)sc1c2CCC(C1)C)CCCC

STK548765
Synonyms: 4-(phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)-8-(1,3-benzodioxol-5-yl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: O=C([C@H]1[C@@H]2[C@H]([C@H]3N1c1ccccc1C=C3)C(=O)N(C2=O)c1ccc2c(c1)OCO2)Oc1ccc(cc1)C(=O)c1ccccc1

STK548766
Synonyms: 5-(phenylamino)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: O=C1c2ccccc2c2c3c1c(Nc1ccccc1)cc(c3no2)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STK548768
Synonyms: 3-[4-(decyloxy)phenyl]-1-ethoxyquinoxalin-2(1H)-one4-oxide
Smiles: CCCCCCCCCCOc1ccc(cc1)c1[n+]([O-])c2ccccc2n(c1=O)OCC

STK548769
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylamino)methyl]-N'-[(E)-{3-[(4-fluorobenzyl)oxy]phenyl}methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)OCc1ccc(cc1)F)CC

STK548770
Synonyms: 3-(2,5-dibromophenyl)-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)[N+](=O)[O-])c1cc(Br)ccc1Br

STK548771
Synonyms: N-{1-[1-(4-tert-butyl-2,6-dimethylbenzyl)-1H-benzimidazol-2-yl]-3-(methylsulfanyl)propyl}benzamide
Smiles: CSCCC(c1nc2c(n1Cc1c(C)cc(cc1C)C(C)(C)C)cccc2)NC(=O)c1ccccc1

STK548772
Synonyms: (4Z)-4-(3-bromo-4,5-diethoxybenzylidene)-2-(2-fluorophenyl)-1,3-oxazol-5(4H)-one
Smiles: CCOc1cc(/C=C/2\N=C(OC2=O)c2ccccc2F)cc(c1OCC)Br

STK548773
Synonyms: 11-(4-methoxybenzyl)-3-(2-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccc(cc1)Cn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1ccccc1OC

STK548774
Synonyms: 3-bromo-N-(4-fluorophenyl)-2-oxo-2H-pyran-5-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1coc(=O)c(c1)Br

STK548775
Synonyms: 4-(2,3-dichlorophenyl)-5-phenyl-2-[3-(phenylethynyl)phenyl]-1H-imidazole
Smiles: Clc1cccc(c1Cl)c1nc([nH]c1c1ccccc1)c1cccc(c1)C#Cc1ccccc1

STK548776
Synonyms: N-[1-(1H-benzimidazol-2-yl)butyl]-5-bromofuran-2-carboxamide
Smiles: CCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccc(o1)Br

STK548777
Synonyms: 3-(2-methyl-5-nitrophenyl)-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Smiles: [O-][N+](=O)c1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1c1cc(ccc1C)[N+](=O)[O-]

STK548778
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-chlorophenyl)carbonyl]-2-(2,4-dichlorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Cl)Cl)C(=O)c1ccccc1

STK548779
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(3,4-dichlorophenyl)ethylidene]-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCCCC1)c1nonc1N)N/N=C(/c1ccc(c(c1)Cl)Cl)\C

STK548780
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-ethoxy-4-[(3-fluorobenzyl)oxy]phenyl}methylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCc1cccc(c1)F

STK548783
Synonyms: 3-[5-(2-bromo-4-methylphenoxy)pentyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1ccc(cc1Br)C

STK548784
Synonyms: 3-butyl-2-(ethylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCn1c(SCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548785
Synonyms: propan-2-yl2-amino-1-(4-ethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK548786
Synonyms: 1-benzyl-2-{[(5-bromofuran-2-yl)carbonyl]amino}-N-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCNC(=O)c1c(NC(=O)c2ccc(o2)Br)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK548787
Synonyms: 3-methyl-1-(4-methylpiperazin-1-yl)-2-phenylbutan-1-one
Smiles: CC(C(C(=O)N1CCN(CC1)C)c1ccccc1)C

STK548788
Synonyms: (1Z)-N'-{[2-(2,4-dichlorophenoxy)propanoyl]oxy}-2-(3,4-dimethoxyphenyl)ethanimidamide
Smiles: COc1cc(ccc1OC)C/C(=N/OC(=O)C(Oc1ccc(cc1Cl)Cl)C)/N

STK548789
Synonyms: 3-tert-butyl-7-{[2-(4-phenylpiperazin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: O=c1c2ccccc2c(=O)c2c1c(NCCN1CCN(CC1)c1ccccc1)cc1c2[nH]c2c(o1)cc(cc2)C(C)(C)C

STK548790
Synonyms: 1,3-bis(2-methoxyphenyl)-5-[(piperidin-1-ylamino)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccccc1N1C(=O)/C(=C/NN2CCCCC2)/C(=O)N(C1=S)c1ccccc1OC

STK548791
Synonyms: 2-imino-N-(2-methoxyethyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: COCCNC(=O)c1cc2c(n(c1=N)CCc1ccccc1)nc1n(c2=O)cccc1

STK548793
Synonyms: 2-[(4-amino-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(furan-2-ylmethyl)acetamide
Smiles: CC1CCc2c(C1)sc1c2c(N)nc(n1)SCC(=O)NCc1ccco1

STK548794
Synonyms: prop-2-en-1-yl2-amino-1-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OCC=C

STK548795
Synonyms: 3-(4-methylphenyl)-10-[(2E)-3-phenylprop-2-enoyl]-11-(pyridin-3-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Cc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccnc1)C(=O)/C=C/c1ccccc1

STK548796
Synonyms: 6-{3-acetyl-2-[4-(dimethylamino)phenyl]-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}hexanoicacid
Smiles: OC(=O)CCCCCN1C(c2ccc(cc2)N(C)C)C(=C(C1=O)O)C(=O)C

STK548798
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[2-(benzyloxy)-3-methoxyphenyl]methylidene}-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1OCc1ccccc1)/C=N/NC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N

STK548800
Synonyms: N-(2-{(2Z)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)-2,2-diphenylacetamide(non-preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)C(c2ccccc2)c2ccccc2)/c2c1cccc2

STK548803
Synonyms: 2-methoxyethyl2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OCCOC

STK548805
Synonyms: (5E)-2-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]-5-{4-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1ccc(cc1)OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1ccc(c(c1)Cl)C

STK548806
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(3-bromophenyl)ethylidene]-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Brc1cccc(c1)/C(=N/NC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N)/C

STK548807
Synonyms: 4-[4-(benzyloxy)-6-methyl-5-nitropyrimidin-2-yl]morpholine
Smiles: [O-][N+](=O)c1c(OCc2ccccc2)nc(nc1C)N1CCOCC1

STK548809
Synonyms: 2-ethoxy-4-{(Z)-[5-oxo-2-(thiophen-2-yl)-1,3-oxazol-4(5H)-ylidene]methyl}phenylbutanoate
Smiles: CCCC(=O)Oc1ccc(cc1OCC)/C=C/1\N=C(OC1=O)c1cccs1

STK548810
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(2,5-dimethylthiophen-3-yl)ethylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1sc(c(c1)/C(=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N)/C)C

STK548811
Synonyms: 2-[(4-butyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)sulfanyl]acetamide
Smiles: CCCCc1nc2sc3c(c2c2c1CCC2)ncnc3SCC(=O)N

STK548813
Synonyms: 2-(4-methoxyphenyl)-3-[2-(2,4,6-trichlorophenoxy)ethyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1c(Cl)cc(cc1Cl)Cl

STK548814
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{5-chloro-2-[(2-chloro-6-fluorobenzyl)oxy]phenyl}methylidene]-5-[(diethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(Cl)ccc1OCc1c(F)cccc1Cl)CC

STK548815
Synonyms: 2-amino-1-(3-chloro-4-methoxyphenyl)-N-(furan-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(cc1Cl)n1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccco1

STK548817
Synonyms: 4-acetyl-1-hexadecyl-3-hydroxy-5-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCCCCCCCCCCCCCN1C(=O)C(=C(C1c1ccc(cc1)C)C(=O)C)O

STK548818
Synonyms: 3-[2-amino-3-(butoxycarbonyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl]benzoicacid
Smiles: CCCCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(=O)O

STK548819
Synonyms: (9E)-9-[4-(difluoromethoxy)benzylidene]-5-[4-(difluoromethoxy)phenyl]-3-(4-nitrophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: FC(Oc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)[N+](=O)[O-])/C(=C/c1ccc(cc1)OC(F)F)/CCC2)F

STK548820
Synonyms: N-(4-bromophenyl)-2-{[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCC3

STK548821
Synonyms: 2-imino-N-(2-methoxyethyl)-1-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: COCCNC(=O)c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1

STK548823
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{5-chloro-2-[(2,6-dichlorobenzyl)oxy]phenyl}methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N)OCc1c(Cl)cccc1Cl

STK548824
Synonyms: 3-{3-hydroxy-4-[(4-methylphenyl)carbonyl]-5-(4-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzoicacid
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1cccc(c1)C(=O)O

STK548825
Synonyms: 3-amino-N-(4-chlorophenyl)-6-methyl-4-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1sc2c(c1N)c(cc(n2)C)c1cccs1

STK548826
Synonyms: 2-methoxy-4-{(E)-[2-({[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenylacetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2c2ccc(cc2)OC)c2ccc(cc2)C)ccc1OC(=O)C

STK548827
Synonyms: N-{1-(3-methoxypropyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}-4-nitrobenzenesulfonamide
Smiles: COCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-])S(=O)(=O)c1ccc(cc1)C

STK548829
Synonyms: 1-[(2,6-difluorobenzyl)oxy]-3-(naphthalen-1-yl)quinoxalin-2(1H)-one4-oxide
Smiles: Fc1cccc(c1COn1c(=O)c(c2cccc3c2cccc3)[n+](c2c1cccc2)[O-])F

STK548830
Synonyms: [3-(3-benzylpyridinium-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl][(4-bromophenyl)sulfonyl]azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2cccc(c2)Cc2ccccc2)C(=O)c2c(C1=O)cccc2

STK548831
Synonyms: 4-(2,5-dimethoxyphenyl)-5-(quinolin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1n1c(S)nnc1c1ccc2c(n1)cccc2)OC

STK548832
Synonyms: 3-[3-(2-chloro-5-methylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(C)ccc1Cl

STK548834
Synonyms: 2-{[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-[2-(4-fluorophenyl)ethyl]acetamide
Smiles: N#Cc1c(SCC(=O)NCCc2ccc(cc2)F)nc(c(c1c1cccs1)C#N)N

STK548835
Synonyms: 4-[(8R,8aS,11aR)-9,11-dioxo-8-(phenylcarbonyl)-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazin-10(11H)-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=N1)C(=O)c1ccccc1

STK548836
Synonyms: ethyl4-[11-(4-methoxyphenyl)-4-oxo-4,11-dihydro-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-3-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)OC

STK548837
Synonyms: N,N'-bis(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-9H-fluorene-2,7-disulfonamide
Smiles: Cc1c(NS(=O)(=O)c2ccc3c(c2)Cc2c3ccc(c2)S(=O)(=O)Nc2c(C)n(n(c2=O)c2ccccc2)C)c(=O)n(n1C)c1ccccc1

STK548838
Synonyms: methyl[3-(4-benzylpiperidin-1-yl)quinoxalin-2-yl](cyano)acetate
Smiles: COC(=O)C(c1nc2ccccc2nc1N1CCC(CC1)Cc1ccccc1)C#N

STK548839
Synonyms: ethyl4,5-dimethyl-2-{[(pyridin-3-ylcarbonyl)carbamothioyl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2cccnc2)sc(c1C)C

STK548840
Synonyms: prop-2-en-1-yl2-amino-1-(2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1OC)OC

STK548841
Synonyms: 2-amino-1-(4-methoxybenzyl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(cc1)Cn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1ccccc1OC

STK548843
Synonyms: N'-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]pyridine-4-carbohydrazide
Smiles: CN1C(=S)N(C)C(=O)C(=CNNC(=O)c2ccncc2)C1=O

STK548844
Synonyms: (8S,8aR,11aS)-8-[(4-methoxyphenyl)carbonyl]-10-phenyl-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3

STK548845
Synonyms: butyl[3-(4-carbamoylpiperidin-1-yl)quinoxalin-2-yl](cyano)acetate
Smiles: CCCCOC(=O)C(c1nc2ccccc2nc1N1CCC(CC1)C(=O)N)C#N

STK548846
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(2,4-dichlorobenzyl)oxy]phenyl}methylidene]-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)OCc1ccc(cc1Cl)Cl

STK548847
Synonyms: 3-amino-6-ethyl-N-(4-methyl-1,3-thiazol-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)Nc1scc(n1)C

STK548849
Synonyms: (2E)-2-cyano-3-[1-(2-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-N-(thiophen-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccccc1F)C)/C(=O)NCc1cccs1

STK548850
Synonyms: N~2~,N~2~-diethyl-N-[4-methyl-2-(phenylcarbonyl)phenyl]glycinamide
Smiles: CCN(CC(=O)Nc1ccc(cc1C(=O)c1ccccc1)C)CC

STK548851
Synonyms: 4-bromo-N-{1-(3-methoxypropyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzenesulfonamide
Smiles: COCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)Br)S(=O)(=O)c1ccc(cc1)C

STK548853
Synonyms: 3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(diethylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCN(c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)CC

STK548854
Synonyms: 2-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-6-methoxyphenylbenzoate
Smiles: COc1cccc(c1OC(=O)c1ccccc1)/C=N/NC(=O)c1nnn(c1CN1CCN(CC1)C)c1nonc1N

STK548855
Synonyms: 4-{[1,1,1,3,3,3-hexafluoro-2-(methoxycarbonyl)propan-2-yl]sulfanyl}-3-methylphenylbenzoate
Smiles: COC(=O)C(C(F)(F)F)(C(F)(F)F)Sc1ccc(cc1C)OC(=O)c1ccccc1

STK548856
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{2-[(3-fluorobenzyl)oxy]-5-nitrophenyl}methylidene]-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(ccc1OCc1cccc(c1)F)[N+](=O)[O-]

STK548858
Synonyms: 2-{[3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(3-ethoxyphenyl)acetamide
Smiles: CCOc1cccc(c1)NC(=O)CSc1nc(cc(c1C#N)c1cccs1)c1ccc(cc1)OC

STK548859
Synonyms: propan-2-yl2-amino-1-pentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCCn1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK548860
Synonyms: 2-{[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)nc(c(c1c1cccs1)C#N)N

STK548861
Synonyms: butylcyano{3-[4-(diphenylmethyl)piperazin-1-yl]quinoxalin-2-yl}acetate
Smiles: CCCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C(c1ccccc1)c1ccccc1)C#N

STK548862
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(4-chlorobenzyl)oxy]phenyl}methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(cc1)COc1cccc(c1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK548866
Synonyms: methyl5-bromo-3-[(3,3-diphenylpropanoyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CC(c1ccccc1)c1ccccc1)cc(cc2)Br

STK548867
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-fluorophenyl)methylidene]-5-(methoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1F

STK548868
Synonyms: (5E)-5-(4-butoxybenzylidene)-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-4(5H)-one
Smiles: CCCCOc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1

STK548869
Synonyms: 3-(4-chlorophenyl)-11-[4-(dimethylamino)phenyl]-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Clc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccc(cc1)N(C)C)C(=O)Cc1ccccc1

STK548870
Synonyms: 5-(biphenyl-4-yl)-2-(3-bromo-4-fluorophenyl)-4-phenyl-1H-imidazole
Smiles: Fc1ccc(cc1Br)c1nc(c([nH]1)c1ccc(cc1)c1ccccc1)c1ccccc1

STK548871
Synonyms: 3-methoxybenzylN'-cyano-N-[3-(trifluoromethyl)phenyl]carbamimidothioate
Smiles: N#C/N=C(/Nc1cccc(c1)C(F)(F)F)\SCc1cccc(c1)OC

STK548873
Synonyms: 2-(4-fluorophenyl)-5,5-dimethyl-4-(pyridin-2-yl)-2,5-dihydro-1H-imidazol-1-ol3-oxide
Smiles: Fc1ccc(cc1)C1[N+](=C(C(N1O)(C)C)c1ccccn1)[O-]

STK548874
Synonyms: 4-bromo-N-{(5Z)-5-[4-(octyloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzamide
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)Br

STK548875
Synonyms: 1-methyl-7-{[2-(3-methylpiperidin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: CC1CCCN(C1)CCNc1cc2oc3cccc(c3[nH]c2c2c1c(=O)c1ccccc1c2=O)C

STK548877
Synonyms: ethyl5-cyano-4-[4-(methoxycarbonyl)phenyl]-2-methyl-6-[(2-oxo-2-phenylethyl)sulfanyl]-1,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)C(=O)OC)C#N)SCC(=O)c1ccccc1

STK548878
Synonyms: N-(1,3-benzodioxol-5-yl)-2-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(s1)SCc1cccc2c1cccc2

STK548879
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}methylidene]-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc1OCc1ccc(cc1)C

STK548880
Synonyms: [3-(3,5-dimethylpiperidin-1-yl)quinoxalin-2-yl][(4-methylphenyl)sulfonyl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CC(C)CC(C1)C

STK548881
Synonyms: 2-({5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N'-[(1E)-1-(naphthalen-1-yl)ethylidene]acetohydrazide
Smiles: O=C(N/N=C(/c1cccc2c1cccc2)\C)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK548882
Synonyms: ethyl4-[(4-chloro-2-methylphenyl)amino]-2-methylquinoline-6-carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)c(cc(n2)C)Nc1ccc(cc1C)Cl

STK548883
Synonyms: 2-{[4-(4-bromophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK548884
Synonyms: (8S,8aR,11aS)-8-[(4-methoxyphenyl)carbonyl]-10-(2-methyl-5-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-])cccc3

STK548886
Synonyms: N-[3-cyano-1-(4-methylphenyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl]propanamide
Smiles: CCC(=O)Nc1c(C#N)c2c(n1c1ccc(cc1)C)nc1c(n2)cccc1

STK548887
Synonyms: N-cyclohexyl-4-{[2-(4-propoxyphenyl)quinazolin-4-yl]oxy}benzamide
Smiles: CCCOc1ccc(cc1)c1nc(Oc2ccc(cc2)C(=O)NC2CCCCC2)c2c(n1)cccc2

STK548888
Synonyms: (2E)-3-(3,4-dimethoxyphenyl)-N-({4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}carbamothioyl)prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)Nc2nnc(s2)CC)ccc1OC

STK548889
Synonyms: (3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(3-fluorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)F)C(=O)c1ccccc1

STK548895
Synonyms: 2'-[({[(9Z)-10-oxophenanthren-9(10H)-ylidene]amino}oxy)carbonyl]biphenyl-2-carbonitrile
Smiles: N#Cc1ccccc1c1ccccc1C(=O)O/N=C/1\C(=O)c2ccccc2c2c1cccc2

STK548897
Synonyms: N-(3-methoxyphenyl)-2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2cccc(c2)OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548898
Synonyms: 4-[(4-chlorophenyl)carbonyl]-3-hydroxy-5-(4-methoxyphenyl)-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: C=CCN1C(c2ccc(cc2)OC)C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK548899
Synonyms: methyl2-({[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)c2c(C)onc2c2ccccc2)sc2c1CCCC2

STK548900
Synonyms: 1-{(2Z)-2-[3-chloro-5-(4-fluorophenyl)-2-(4-methylphenyl)-1-benzoxepin-4(5H)-ylidene]ethyl}piperidine
Smiles: Cc1ccc(cc1)C1=C(Cl)/C(=C\CN2CCCCC2)/C(c2c(O1)cccc2)c1ccc(cc1)F

STK548901
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}methylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCc1ccc(cc1)Cl

STK548903
Synonyms: (5Z)-2-[(3-bromophenyl)amino]-5-(4-ethoxy-3-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: CCOc1ccc(cc1OC)/C=C/1\SC(=NC1=O)Nc1cccc(c1)Br

STK548904
Synonyms: [5-(4-bromophenyl)-1',3'-diphenyl-3,4-dihydro-1'H,2H-3,4'-bipyrazol-2-yl](furan-2-yl)methanone
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1cn(nc1c1ccccc1)c1ccccc1)C(=O)c1ccco1

STK548905
Synonyms: 2-{2-[(4-amino-6-propyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethyl}-1H-isoindole-1,3(2H)-dione
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCCN1C(=O)c2c(C1=O)cccc2

STK548906
Synonyms: (5Z)-1-(4-fluorophenyl)-5-({1-[3-(3-methoxyphenoxy)propyl]-1H-indol-3-yl}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1cccc(c1)OCCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)F

STK548907
Synonyms: 2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK548908
Synonyms: ethyl3-({2-[4-(3-chlorophenyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)c1cccc(c1)Cl)C)cccc2

STK548909
Synonyms: 5-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-[(4-methylphenyl)sulfonyl]-4,5-dihydro-1H-pyrazole
Smiles: COc1ccc(cc1OC)C1=NN(C(C1)c1ccc(cc1)Cl)S(=O)(=O)c1ccc(cc1)C

STK548910
Synonyms: (2E,5Z)-5-(thiophen-2-ylmethylidene)-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazolidin-4-one
Smiles: O=C1N/C(=N\c2cccc(c2)C(F)(F)F)/S/C/1=C\c1cccs1

STK548911
Synonyms: (8R,8aS,11aR)-10-(4-bromophenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)Br)cccc3

STK548912
Synonyms: 2-methoxy-6-{4-[(4-methoxyphenyl)amino]quinazolin-2-yl}phenol
Smiles: COc1ccc(cc1)Nc1nc(nc2c1cccc2)c1cccc(c1O)OC

STK548913
Synonyms: 11-(1,3-benzodioxol-5-ylmethyl)-3-hexyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc2c(c1)OCO2

STK548914
Synonyms: (5Z)-3-(2-bromophenyl)-5-(1H-indol-3-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2c[nH]c3c2cccc3)/C(=O)N1c1ccccc1Br

STK548915
Synonyms: 6-ethyl-6-methyl-2-(methylsulfanyl)-4-[(naphthalen-2-ylmethyl)sulfanyl]-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCC1(C)OCc2c(C1)c1c(SCc3ccc4c(c3)cccc4)nc(nc1s2)SC

STK548917
Synonyms: 2-(4-chlorophenyl)-3-[4-(2-iodophenoxy)butyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccccc1I

STK548918
Synonyms: 2-(4-{4-[(3-bromophenyl)amino]phthalazin-1-yl}phenoxy)-1-(piperidin-1-yl)ethanone
Smiles: Brc1cccc(c1)Nc1nnc(c2c1cccc2)c1ccc(cc1)OCC(=O)N1CCCCC1

STK548919
Synonyms: N-(4-ethoxyphenyl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccco2)c(nn1c1ccccc1)C

STK548920
Synonyms: N-benzyl-2-[(3-ethyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCn1c(SCC(=O)NCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548921
Synonyms: N-benzyl-2,2-dichloro-1-phenylcyclopropanecarboxamide
Smiles: O=C(C1(CC1(Cl)Cl)c1ccccc1)NCc1ccccc1

STK548922
Synonyms: 2-(benzylsulfanyl)-3-(3-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: Cc1cccc(c1)n1c(SCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK548923
Synonyms: N-(2-fluorophenyl)-5-nitro-2-(piperidin-1-yl)pyrimidine-4,6-diamine
Smiles: [O-][N+](=O)c1c(N)nc(nc1Nc1ccccc1F)N1CCCCC1

STK548924
Synonyms: 3,4,5-trimethoxy-N-[(2-{[(1S,2S)-2-phenylcyclopropyl]carbonyl}hydrazinyl)carbonothioyl]benzamide
Smiles: COc1c(OC)cc(cc1OC)C(=O)NC(=S)NNC(=O)[C@H]1C[C@@H]1c1ccccc1

STK548925
Synonyms: 2-[(3-fluorobenzyl)sulfanyl]-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Fc1cccc(c1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)C

STK548926
Synonyms: methyl2-[(3-{[(4-chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoate
Smiles: COC(=O)c1ccccc1Nc1nc2ccccc2nc1NS(=O)(=O)c1ccc(cc1)Cl

STK548927
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1Z)-1-(2-chlorophenyl)ethylidene]-5-(phenoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1COc1ccccc1)C(=O)N/N=C(\c1ccccc1Cl)/C

STK548928
Synonyms: 1-methoxypropan-2-yl2-amino-1-pentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OC(COC)C

STK548930
Synonyms: 2-amino-1-(2-methylpropyl)-N-pentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CC(C)C

STK548931
Synonyms: N'-(bicyclo[4.1.0]hept-7-ylcarbonyl)-3-bromo-2-oxo-2H-pyran-5-carbohydrazide
Smiles: O=C(C1C2C1CCCC2)NNC(=O)c1coc(=O)c(c1)Br

STK548932
Synonyms: 1-amino-5-(morpholin-4-yl)-N-phenyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)Nc1ccccc1

STK548933
Synonyms: 1-amino-N-(4-chlorophenyl)-5-(morpholin-4-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK548934
Synonyms: 1-(2,4-dinitronaphthalen-1-yl)pyrrolidine
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c2c(c1N1CCCC1)cccc2

STK548936
Synonyms: 2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]acetohydrazide
Smiles: CCn1c(SCC(=O)N/N=C/C(=C/c2ccccc2)/Cl)nnc1c1ccc(cc1)C(C)(C)C

STK548937
Synonyms: 3-{2-[2-(3-chlorophenoxy)ethoxy]ethyl}-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1cccc(c1)Cl

STK548938
Synonyms: N-(2,5-dimethylphenyl)-N-[(2-hydroxy-6-methylquinolin-3-yl)methyl]-2-methylbenzamide
Smiles: Cc1ccc(c(c1)N(C(=O)c1ccccc1C)Cc1cc2cc(C)ccc2nc1O)C

STK548939
Synonyms: 2-(4-chlorophenyl)-1-(3-methylphenyl)-1H-imidazo[4,5-b]quinoxaline
Smiles: Clc1ccc(cc1)c1nc2c(n1c1cccc(c1)C)nc1c(n2)cccc1

STK548940
Synonyms: 3-[(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]phenyl2-chlorobenzoate
Smiles: O=C(c1ccccc1Cl)Oc1cccc(c1)NC1=C(Cl)C(=O)c2c(C1=O)cccc2

STK548941
Synonyms: N-[4-(benzyloxy)phenyl]-2-[(5-ethyl-4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
Smiles: CCc1c(C)nc([nH]c1=O)SCC(=O)Nc1ccc(cc1)OCc1ccccc1

STK548943
Synonyms: 12-(3-methylbenzyl)-9-[(3-methylbenzyl)sulfanyl]-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7(12H)-one
Smiles: Cc1cccc(c1)CSc1nnc2n1c(=O)c1c(n2Cc2cccc(c2)C)c2ccccc2CC21CCCC2

STK548944
Synonyms: 3-[(4-bromobenzyl)sulfanyl]-11-propyl-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnc1SCc1ccc(cc1)Br

STK548945
Synonyms: 2-[(2-methylbenzyl)sulfanyl]-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: Cc1ccccc1CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK548946
Synonyms: 5-ethyl-5-methyl-3-(2-phenylethyl)-2-(propan-2-ylsulfanyl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n(c(n2)SC(C)C)CCc1ccccc1

STK548947
Synonyms: (5Z)-1-(4-ethylphenyl)-5-[(1-{2-[2-(prop-2-en-1-yl)phenoxy]ethyl}-1H-indol-3-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: C=CCc1ccccc1OCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)CC

STK548948
Synonyms: (4aR,8aS)-1,4-bis[(4-fluorobenzyl)oxy]octahydroquinoxaline-2,3-dione
Smiles: O=C1N(OCc2ccc(cc2)F)[C@@H]2CCCC[C@@H]2N(C1=O)OCc1ccc(cc1)F

STK548949
Synonyms: 8-cyclohexylidene-2-(4-fluorophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: O=C1C2C(C(=O)N1c1ccc(cc1)F)C1C(=C3CCCCC3)C2C=C1

STK548951
Synonyms: 2-{[6-iodo-3-(2-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N,N-dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2ccc(cc2c(=O)n1c1ccccc1OC)I)CCC

STK548952
Synonyms: 1-(4-ethoxyphenyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccc(cc1)C

STK548953
Synonyms: 2-chloro-10-[3,5-difluoro-2,6-di(piperidin-1-yl)pyridin-4-yl]-10H-phenothiazine
Smiles: Clc1ccc2c(c1)N(c1c(F)c(nc(c1F)N1CCCCC1)N1CCCCC1)c1c(S2)cccc1

STK548955
Synonyms: (8R,8aS,11aR)-N-(4-chlorophenyl)-10-(2,4-dimethylphenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-8-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3

STK548956
Synonyms: (2E)-N-(3-chlorophenyl)-2-cyano-2-[(5E)-5-(4-methylbenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: N#C/C(=c/1\s/c(=C/c2ccc(cc2)C)/c(=O)n1c1ccccc1)/C(=O)Nc1cccc(c1)Cl

STK548958
Synonyms: 4-(3,5-dimethylphenoxy)-2-(pyridin-2-yl)quinazoline
Smiles: Cc1cc(C)cc(c1)Oc1nc(nc2c1cccc2)c1ccccn1

STK548959
Synonyms: 2-(2-{[4-amino-6-(propan-2-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: CC(C1OCc2c(C1)c1c(N)nc(nc1s2)SCCN1C(=O)c2c(C1=O)cccc2)C

STK548961
Synonyms: N-[3-(dimethylamino)-2-hydroxypropyl]-4-methyl-N-phenylbenzenesulfonamide
Smiles: CN(CC(CN(S(=O)(=O)c1ccc(cc1)C)c1ccccc1)O)C

STK548963
Synonyms: (5Z)-5-({1-[3-(2,3-dimethylphenoxy)propyl]-1H-indol-3-yl}methylidene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2cccc(c2C)C)/C(=O)N1Cc1ccco1

STK548966
Synonyms: N-{[2-(pyridin-3-yl)piperidin-1-yl]carbonothioyl}-9H-xanthene-9-carboxamide
Smiles: S=C(N1CCCCC1c1cccnc1)NC(=O)C1c2ccccc2Oc2c1cccc2

STK548969
Synonyms: 4-(naphthalen-2-yloxy)-2-[4-(propan-2-yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(Oc2ccc3c(c2)cccc3)c2c(n1)cccc2)C

STK548970
Synonyms: N-(4-chlorophenyl)-2-[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)COc1ccc2c(c1C)oc(=O)c(c2C)C

STK548971
Synonyms: 7-[(4-bromobenzyl)sulfanyl]-4-butyl-2,3,5a,10b-tetrahydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3SCc1ccc(cc1)Br

STK548974
Synonyms: 3-methyl-7-{[2-(4-methylpiperazin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: CN1CCN(CC1)CCNc1cc2oc3cc(C)ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1

STK548975
Synonyms: 1-(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1cc(Cl)ccc1C)c(n2Cc1ccccc1)C

STK548976
Synonyms: 1-(4-chlorophenyl)-2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nnc1c1cccnc1

STK548977
Synonyms: 2-[(3-benzyl-6-iodo-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N,N-diphenylacetamide
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)SCC(=O)N(c1ccccc1)c1ccccc1)Cc1ccccc1

STK548978
Synonyms: 2-[4-(3,5-dimethylpiperidin-1-yl)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc2ccccc2c(n1)N1CC(C)CC(C1)C

STK548979
Synonyms: (5Z)-3-(2-bromophenyl)-5-[4-(octyloxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1ccccc1Br

STK548981
Synonyms: 1-(4-bromophenyl)-2-(4-chlorophenyl)-1H-imidazo[4,5-b]quinoxaline
Smiles: Clc1ccc(cc1)c1nc2c(n1c1ccc(cc1)Br)nc1c(n2)cccc1

STK548982
Synonyms: (2Z)-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl][2-(4-fluorophenyl)hydrazinylidene]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)F)/c1scc(n1)c1ccc2c(c1)OCO2

STK548983
Synonyms: 2-{4-[(2-methoxyethyl)amino]quinazolin-2-yl}phenol
Smiles: COCCNc1nc(nc2c1cccc2)c1ccccc1O