FULL DB

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

STK542696
Synonyms: N-[4-(acetylamino)phenyl]-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)Nc2ccc(cc2)NC(=O)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK542698
Synonyms: 2-(4-chlorophenyl)-5-[4-(hexyloxy)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: CCCCCCOc1ccc(cc1)C1Oc2ccccc2C2N1N=C(C2)c1ccc(cc1)Cl

STK542699
Synonyms: 2,2-diphenyl-4-(piperazin-1-yl)butanenitrile
Smiles: N#CC(c1ccccc1)(c1ccccc1)CCN1CCNCC1

STK542701
Synonyms: ethyl5-fluoro-3-[(2-phenylbutanoyl)amino]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(c1ccccc1)CC)cc(cc2)F

STK542702
Synonyms: 3-benzyl-2-[(E)-2-(1,2-dimethyl-1H-indol-3-yl)ethenyl]-6-iodoquinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1c2ccccc2n(c1C)C)Cc1ccccc1

STK542703
Synonyms: 2-[(E)-2-(4-fluorophenyl)ethenyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(/C=C/c2ccc(cc2)F)nc2c(c1=O)cc(cc2)I

STK542704
Synonyms: 7-hydrazinyl-4-(morpholin-4-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: NNc1ncnc2c1sc1c2c2CCCc2c(n1)N1CCOCC1

STK542705
Synonyms: 1-(benzylsulfanyl)-7,7-dimethyl-4-(3-methylphenyl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Cc1cccc(c1)n1c(=O)c2c3CC(C)(C)OCc3sc2n2c1nnc2SCc1ccccc1

STK542706
Synonyms: (4Z)-5-(4-chlorophenyl)-4-(1-hydroxyethylidene)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)C1/C(=C(/O)\C)/C(=O)C(=O)N1c1cccc(c1)C(F)(F)F

STK542707
Synonyms: 11-(3,5-dichlorophenyl)-3-phenyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Clc1cc(Cl)cc(c1)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1ccccc1

STK542708
Synonyms: (3aR,6aS)-5-(2-fluorophenyl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: O=C1[C@H]2[C@@H](C(=O)N1c1ccccc1F)ON=C2c1ccc(cc1)[N+](=O)[O-]

STK542710
Synonyms: 2-[4-(6-bromo-4-phenylquinolin-2-yl)phenoxy]-N'-[(E)-(2-chloro-6-methoxyquinolin-3-yl)methylidene]acetohydrazide
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)/C=N/NC(=O)COc1ccc(cc1)c1nc2ccc(cc2c(c1)c1ccccc1)Br

STK542711
Synonyms: N-(4-bromophenyl)-2-[(4-oxo-3-phenyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3

STK542712
Synonyms: ethyl3-[(cyclohexylcarbamoyl)amino]-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)NC1CCCCC1)cc(cc2)OC

STK542713
Synonyms: 2-(1,3-benzoxazol-2-ylsulfanyl)-N'-[(E)-(2-fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nc2c(o1)cccc2)N/N=C/c1ccccc1F

STK542714
Synonyms: 3-methyl-8-[(naphthalen-2-ylmethyl)sulfanyl]-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(SCc2ccc3c(c2)cccc3)nc2c1c(=O)[nH]c(=O)n2C

STK542716
Synonyms: 1-{11-[2-(benzyloxy)phenyl]-1-hydroxy-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}hexan-1-one
Smiles: CCCCCC(=O)N1C(C2=C(O)CC(CC2=Nc2c1cccc2)(C)C)c1ccccc1OCc1ccccc1

STK542717
Synonyms: (8R,8aR)-6-amino-8-(2-methoxynaphthalen-1-yl)-2-propyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: CCCN1CC=C2[C@H](C1)[C@@H](c1c(OC)ccc3c1cccc3)C(C(=C2C#N)N)(C#N)C#N

STK542719
Synonyms: 3-benzyl-2-[(Z)-(5-bromo-2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)methyl]-6-iodoquinazolin-4(3H)-one
Smiles: CCCN1c2ccc(cc2/C(=C/c2nc3ccc(cc3c(=O)n2Cc2ccccc2)I)/C1=O)Br

STK542720
Synonyms: 2-[4-(2-chlorobenzyl)piperazin-1-yl]-N'-[(E)-(2,4-dichlorophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1Cl)N/N=C/c1ccc(cc1Cl)Cl

STK542721
Synonyms: methyl(1R,2R,3S)-2-(4-bromophenyl)-1-[(4-chlorophenyl)carbonyl]-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](N2C1C=Cc1c2cccc1)C(=O)c1ccc(cc1)Cl

STK542722
Synonyms: 2-cyclopropyl-N'-{(E)-[4-(diethylamino)phenyl]methylidene}quinoline-4-carbohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1)CC

STK542723
Synonyms: ethyl(8S,8aR)-6-amino-5,7,7-tricyano-8-[3-methoxy-4-(propan-2-yloxy)phenyl]-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccc(c(c1)OC)OC(C)C)C(C(=C2C#N)N)(C#N)C#N

STK542724
Synonyms: 3-benzyl-2-ethyl-11-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCc1nc2n(c3cccc(c3)C)c3c(c2c(=O)n1Cc1ccccc1)nc1c(n3)cccc1

STK542725
Synonyms: diphenylmethyl(1'R,2'S,3R)-2'-[(3,4-dimethoxyphenyl)carbonyl]-2-oxo-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinoline]-1'-carboxylate
Smiles: COc1cc(ccc1OC)C(=O)[C@@H]1[C@H](C(=O)OC(c2ccccc2)c2ccccc2)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STK542726
Synonyms: N-(4-chlorophenyl)-10-methyl-8,11-diphenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Clc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1)C)c1ccccc1

STK542727
Synonyms: 1-(4-bromophenyl)-3-[(4-bromophenyl)amino]-5-(3-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Brc1ccc(cc1)NC1=CC(N(C1=O)c1ccc(cc1)Br)c1cccc(c1)F

STK542728
Synonyms: 8,8-dimethyl-3-(3-methylphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CC(=C)CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1cccc(c1)C

STK542729
Synonyms: N-(2-methoxyphenyl)-2-{[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)n1c(SCC(=O)Nc2ccccc2OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK542730
Synonyms: 3-bromo-N-(9-ethyl-9H-carbazol-3-yl)-2-oxo-2H-pyran-5-carboxamide
Smiles: CCn1c2ccc(cc2c2c1cccc2)NC(=O)c1coc(=O)c(c1)Br

STK542731
Synonyms: 5-[3-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: COc1ccc(cc1OC)C1=NN(C(C1)c1ccc(cc1)F)C(=O)CCCC(=O)O

STK542733
Synonyms: (1'R,2'S,3R)-1'-acetyl-2'-[(4-bromophenyl)carbonyl]-7'-chloro-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1[C@H](C(=O)C)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl

STK542736
Synonyms: N-{1-butyl-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}-4-chlorobenzenesulfonamide
Smiles: CCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)Cl)S(=O)(=O)c1ccc(cc1)C

STK542737
Synonyms: diphenylmethyl(6aR,6bS,9aR,10S)-8-(2-fluorophenyl)-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]1N2c3ccccc3C=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1F)OC(c1ccccc1)c1ccccc1

STK542738
Synonyms: 2-{[2-(morpholin-4-yl)ethyl]amino}-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: S=C1S/C(=C\c2c(NCCN3CCOCC3)nc3n(c2=O)cccc3)/C(=O)N1CC1CCCO1

STK542739
Synonyms: 2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK542740
Synonyms: 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N'-[(1E)-1-(3,4-dimethoxyphenyl)ethylidene]acetohydrazide
Smiles: COc1cc(ccc1OC)/C(=N/NC(=O)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)/C

STK542742
Synonyms: (4E)-5-(2,4-dichlorophenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccc(cc1Cl)Cl

STK542743
Synonyms: 7-{4-[(2-bromo-4-methylphenyl)carbamothioyl]piperazin-1-yl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)Nc1ccc(cc1Br)C)c(c2)F

STK542744
Synonyms: N-benzyl-N-[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]propanamide
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)CC)Cc1ccccc1

STK542745
Synonyms: 3-phenyl-11-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: C=CCn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1ccccc1

STK542746
Synonyms: 4-[4-(4-fluorobenzyl)piperazin-1-yl]-5-(4-fluorophenyl)thieno[2,3-d]pyrimidine
Smiles: Fc1ccc(cc1)CN1CCN(CC1)c1ncnc2c1c(cs2)c1ccc(cc1)F

STK542748
Synonyms: 2-amino-N-cyclopropyl-1-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)NC1CC1

STK542749
Synonyms: 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-2,2-dimethyl-1',2,3,5,6,10b'-hexahydrospiro[pyran-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: FC(Oc1ccc(cc1)C1=NN2C(C1)c1cc(Br)ccc1OC12CCOC(C1)(C)C)F

STK542750
Synonyms: 2-butyl-1-{[3-(diethylamino)propyl]amino}-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCc1c(C)c(C#N)c2n(c1NCCCN(CC)CC)c1ccccc1n2

STK542751
Synonyms: 3-{[4-(diphenylmethyl)piperazin-1-yl]carbonyl}-1-(4-methylphenyl)-7,8-dihydroquinoline-2,5(1H,6H)-dione
Smiles: Cc1ccc(cc1)n1c2CCCC(=O)c2cc(c1=O)C(=O)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK542752
Synonyms: 6-iodo-3-(3-methylphenyl)-2-[(2-phenylethyl)sulfanyl]quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)SCCc1ccccc1)c1cccc(c1)C

STK542753
Synonyms: (2E,5Z)-5-(4-ethoxy-3-methoxybenzylidene)-2-{[2-(trifluoromethyl)phenyl]imino}-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1OC)/C=C/1\S/C(=N/c2ccccc2C(F)(F)F)/NC1=O

STK542754
Synonyms: 1-[3-(4-chlorophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2,2-dimethylpropan-1-one
Smiles: Clc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)C(C)(C)C

STK542755
Synonyms: 4-[(2,5-dichlorophenyl)carbamoyl]benzene-1,3-dicarboxylicacid
Smiles: Clc1ccc(c(c1)NC(=O)c1ccc(cc1C(=O)O)C(=O)O)Cl

STK542756
Synonyms: diethyl[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]propanedioate
Smiles: CCOC(=O)C(C(=O)OCC)Sc1nc2ccccc2c(=O)n1c1ccccc1

STK542757
Synonyms: 3-[(3-methylbutyl)sulfanyl]-11-(2-methylpropyl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CC(CCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)CC(C)C)C

STK542758
Synonyms: 6,6-dimethyl-3-(2-phenylethyl)-2-{[4-(propan-2-yloxy)benzyl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(Oc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)(C)C)C

STK542759
Synonyms: {[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}aceticacid
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)O)nc2c(c1=O)c1CCCCc1s2

STK542760
Synonyms: butyl[4-hydroxy-6-methyl-2-(octylsulfanyl)pyrimidin-5-yl]acetate
Smiles: CCCCCCCCSc1nc(C)c(c(n1)O)CC(=O)OCCCC

STK542761
Synonyms: 2-amino-1-benzyl-N-(4-ethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK542762
Synonyms: 2-[4-(4-chlorobenzyl)piperazin-1-yl]-N'-[(E)-(4-fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1ccc(cc1)F

STK542763
Synonyms: 5-(2-methyl-5-nitrophenyl)-4-phenyl-2-[4-(propan-2-yl)phenyl]-1H-imidazole
Smiles: Cc1ccc(cc1c1[nH]c(nc1c1ccccc1)c1ccc(cc1)C(C)C)[N+](=O)[O-]

STK542764
Synonyms: 2-{[2-(2-hydroxyethoxy)ethyl]amino}-9-methyl-3-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: OCCOCCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccccc1

STK542765
Synonyms: 1-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-7,7-dimethyl-4-(2-phenylethyl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CC(OC3)(C)C

STK542766
Synonyms: dipropan-2-yl[(2,4-dichlorophenyl)(hydroxy)methyl]phosphonate
Smiles: CC(OP(=O)(C(c1ccc(cc1Cl)Cl)O)OC(C)C)C

STK542767
Synonyms: ethyl{[6-iodo-3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2ccc(cc2c(=O)n1c1ccccc1C)I

STK542768
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccc(cc1)OCC

STK542769
Synonyms: 2-amino-N-(4-ethoxyphenyl)-1-phenyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccccc1

STK542770
Synonyms: ethyl5'-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-2,3'-bithiophene-4'-carboxylate
Smiles: CCOC(=O)c1c(/N=C/c2cc(Br)ccc2O)scc1c1cccs1

STK542772
Synonyms: N-(4-phenylbutan-2-yl)-2-[(4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)sulfanyl]acetamide
Smiles: CC(NC(=O)CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1)CCc1ccccc1

STK542773
Synonyms: 1-(4-chlorophenyl)-2-(4-nitrophenyl)-1H-imidazo[4,5-b]quinoxaline
Smiles: Clc1ccc(cc1)n1c(nc2c1nc1ccccc1n2)c1ccc(cc1)[N+](=O)[O-]

STK542777
Synonyms: N-(4-bromophenyl)-10-methyl-8-phenyl-11-(thiophen-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Brc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccs1)C)c1ccccc1

STK542782
Synonyms: N-{2-[(6-chloro-1,3-benzothiazol-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)Nc1nc2c(s1)cc(cc2)Cl

STK542783
Synonyms: 2-(benzylsulfanyl)-6-iodo-3-(4-methylphenyl)quinazolin-4(3H)-one
Smiles: Cc1ccc(cc1)n1c(SCc2ccccc2)nc2c(c1=O)cc(cc2)I

STK542784
Synonyms: N-(3-methoxyphenyl)-2-{[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

STK542785
Synonyms: 2-(2,6-dimethylmorpholin-4-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: CC1OC(C)CN(C1)c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC1CCCO1)C

STK542786
Synonyms: 1-(3-chlorophenyl)-N-(2-methoxyethyl)-2-[(phenylsulfonyl)amino]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCNC(=O)c1c(NS(=O)(=O)c2ccccc2)n(c2c1nc1ccccc1n2)c1cccc(c1)Cl

STK542787
Synonyms: 3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(thiomorpholin-4-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCSCC2)/C1=O)C

STK542788
Synonyms: (2Z)-N-(2-chlorophenyl)-2-cyano-2-[5-(4-methoxybenzyl)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: N#C/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)OC)/C(=O)Nc1ccccc1Cl

STK542789
Synonyms: 2-{[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK542790
Synonyms: 4-methyl-N-{3-[(4-methylphenyl)sulfonyl]-1-pentyl-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzenesulfonamide
Smiles: CCCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)C)S(=O)(=O)c1ccc(cc1)C

STK542791
Synonyms: 2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-5-phenyl-1H-imidazole
Smiles: COc1ccc(cc1)c1nc([nH]c1c1ccccc1)c1c(F)cccc1Cl

STK542792
Synonyms: 2-methyl-N'-[(2E,3E)-4-phenylbut-3-en-2-ylidene]quinoline-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1cc(C)nc2c1cccc2)/C=C/c1ccccc1

STK542793
Synonyms: N-(2,4-dichlorophenyl)-2-{[6,6-dimethyl-3-(4-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C

STK542794
Synonyms: (6aR,6bS,9aR,10S)-N-(4-chlorophenyl)-8-(4-methylphenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxamide
Smiles: Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)Cl

STK542795
Synonyms: 3-benzyl-1-[2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl]pyrrolidine-2,5-dione
Smiles: O=c1oc2cc(ccc2c(c1)C(F)(F)F)N1C(=O)CC(C1=O)Cc1ccccc1

STK542797
Synonyms: ethyl3-({3-[4-(2-fluorophenyl)piperazin-1-yl]propanoyl}amino)-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1F)cc(cc2)OC

STK542799
Synonyms: N-(2,3-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: Cc1nn(c2c1C(c1ccc(cc1)C(C)C)n1c(=N2)c(Nc2cccc(c2C)C)nc2c1cccc2)c1ccccc1

STK542800
Synonyms: 8-chloro-4-(3,3-dimethylpiperidin-1-yl)-5H-pyrimido[5,4-b]indole
Smiles: Clc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCCC(C1)(C)C

STK542801
Synonyms: (1'R,2'S,3R)-1'-[(3-nitrophenyl)carbonyl]-2'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: O=C([C@@H]1N2c3ccccc3C=CC2[C@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)c1cccc(c1)[N+](=O)[O-]

STK542802
Synonyms: 2-(2,6-dimethylmorpholin-4-yl)-3-{(Z)-[3-(4-methoxybenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: COc1ccc(cc1)CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CC(C)OC(C2)C)/C1=O

STK542803
Synonyms: 4-[5-(2,5-dimethylphenyl)-4-phenyl-1H-imidazol-2-yl]-2-ethoxyphenol
Smiles: CCOc1cc(ccc1O)c1nc(c([nH]1)c1cc(C)ccc1C)c1ccccc1

STK542804
Synonyms: N-(2-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: COc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)C)c(nn1c1ccccc1)C

STK542805
Synonyms: 2-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-1-[(2-hydroxyethyl)amino]anthracene-9,10-dione
Smiles: OCCNc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)N1CCc2c(C1)cccc2

STK542806
Synonyms: 3-(furan-2-ylmethyl)-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: O=C(N1CCCCC1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK542810
Synonyms: 3-benzyl-11-(4-bromophenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Brc1ccc(cc1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)Cc1ccccc1

STK542811
Synonyms: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(2,5-dimethoxyphenyl)thiourea
Smiles: COc1ccc(c(c1)NC(=S)NN1CCN(CC1)Cc1ccc2c(c1)OCO2)OC

STK542813
Synonyms: 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N'-[(1E,2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]acetohydrazide
Smiles: COc1ccccc1/C=C/C=N/NC(=O)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br

STK542816
Synonyms: N-benzyl-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(CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3)NCc1ccccc1

STK542817
Synonyms: 3-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2OC)/C1=O

STK542818
Synonyms: 6-iodo-3-(4-methoxyphenyl)-2-(prop-2-en-1-ylsulfanyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(SCC=C)nc2c(c1=O)cc(cc2)I

STK542819
Synonyms: 3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-2-(4-methylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCOCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)C)/C1=O

STK542820
Synonyms: 2-[(3-benzyl-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)n1Cc1ccccc1)CCCCC3

STK542821
Synonyms: (4Z)-1-[2-(diethylamino)ethyl]-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(=O)C(=O)N(C1c1ccc(cc1)OC)CCN(CC)CC)/O

STK542823
Synonyms: 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N'-[(Z)-(3-nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C\c1cccc(c1)[N+](=O)[O-]

STK542824
Synonyms: 8-ethoxy-5-(furan-2-yl)-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCOc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK542829
Synonyms: N-(2,3-dimethylphenyl)-12-propyl-9,10-dihydro-9,10-ethanoanthracene-11-carboxamide
Smiles: CCCC1C(C(=O)Nc2cccc(c2C)C)C2c3c(C1c1c2cccc1)cccc3

STK542830
Synonyms: 5-ethyl-5-methyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3-phenyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n(c(n2)SCC(=C)C)c1ccccc1

STK542831
Synonyms: 2-[4-(4-methylbenzyl)piperazin-1-yl]-N'-[(E)-phenylmethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1ccccc1

STK542832
Synonyms: 2-[4-(4-methylbenzyl)piperazin-1-yl]-N'-[(3E)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C\1/C(=O)Nc2c1cccc2

STK542834
Synonyms: 8-fluoro-3-{[(E)-(4-methoxyphenyl)methylidene]amino}-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)F

STK542835
Synonyms: (1R,2R)-1-[(4-chlorophenyl)carbonyl]-2-phenyl-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Smiles: N#CC1(C#N)[C@@H](c2ccccc2)[C@@H](N2C1C=Cc1c2cccc1)C(=O)c1ccc(cc1)Cl

STK542836
Synonyms: 6-methoxy-N-[3-(morpholin-4-yl)propyl]-2-oxo-2H-chromene-3-carboxamide
Smiles: COc1ccc2c(c1)cc(c(=O)o2)C(=O)NCCCN1CCOCC1

STK542837
Synonyms: prop-2-en-1-yl6-({2-[(3-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(c(c1)OC)O)C#N)SCC(=O)Nc1cccc(c1)C(=O)C

STK542838
Synonyms: 9-[(4-bromobenzyl)sulfanyl]-8-(4-methoxyphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)Br)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK542841
Synonyms: 2-(4-chlorophenyl)-3-phenyltetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one
Smiles: Clc1ccc(cc1)N1C(=O)N2N(C1c1ccccc1)CCC2

STK542842
Synonyms: 3-benzyl-5-ethyl-2-(hexylsulfanyl)-5-methyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CCCCCCSc1nc2c3ccccc3CC(c2c(=O)n1Cc1ccccc1)(C)CC

STK542844
Synonyms: 3-{[(E)-(2-hydroxy-5-methyl-3-nitrophenyl)methylidene]amino}-2-propylquinazolin-4(3H)-one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1cc(C)cc(c1O)[N+](=O)[O-]

STK542846
Synonyms: 2-amino-1-(1,3-benzodioxol-5-yl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCO2)Nc1c(C)n(n(c1=O)c1ccccc1)C

STK542847
Synonyms: 2'-(1,3-benzodioxol-5-yl)-9'-bromo-1-methyl-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1ccc2c(c1)OCO2)Br

STK542848
Synonyms: 2-(5-bromo-2,4-dimethoxyphenyl)-4-(4-bromophenyl)-5-phenyl-1H-imidazole
Smiles: COc1cc(OC)c(cc1c1[nH]c(c(n1)c1ccc(cc1)Br)c1ccccc1)Br

STK542849
Synonyms: (2E)-N-{3-[(4-methylphenyl)sulfonyl]-1-pentyl-1H-pyrrolo[2,3-b]quinoxalin-2-yl}-3-phenylprop-2-enamide
Smiles: CCCCCn1c2nc3ccccc3nc2c(c1NC(=O)/C=C/c1ccccc1)S(=O)(=O)c1ccc(cc1)C

STK542851
Synonyms: (2E)-1-[5-(2,5-dimethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-phenylprop-2-en-1-one
Smiles: COc1ccc(c(c1)C1CC(=NN1C(=O)/C=C/c1ccccc1)c1ccc(cc1)C)OC

STK542852
Synonyms: (8S,8aR,11aS,11bS)-10-(3-fluorophenyl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccccc2)N=Cc2c1cccc2

STK542854
Synonyms: 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N'-[(E)-(3-methylthiophen-2-yl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1sccc1C

STK542855
Synonyms: 1-[(4-bromo-2,5-dimethoxyphenyl)sulfonyl]-4-(diphenylmethyl)piperazine
Smiles: COc1cc(Br)c(cc1S(=O)(=O)N1CCN(CC1)C(c1ccccc1)c1ccccc1)OC

STK542857
Synonyms: diphenylmethyl(8S,8aR,11aS)-10-(4-fluorophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxylate
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)OC(c2ccccc2)c2ccccc2)C=Cc2c1cccc2

STK542858
Synonyms: 2-[(2-benzyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nc(Cc2ccccc2)nc2c1c1CC(C)(C)OCc1s2

STK542859
Synonyms: bis(2-methylpropyl)[(phenylamino)(3,4,5-trimethoxyphenyl)methyl]phosphonate
Smiles: COc1cc(cc(c1OC)OC)C(P(=O)(OCC(C)C)OCC(C)C)Nc1ccccc1

STK542860
Synonyms: 2-{[3-(2-methylphenyl)-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)n1c1ccccc1C)CCCCC3

STK542861
Synonyms: 3-{[(E)-(4-bromo-1-hydroxynaphthalen-2-yl)methylidene]amino}-2-propylquinazolin-4(3H)-one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1cc(Br)c2c(c1O)cccc2

STK542862
Synonyms: 2,2-dimethyl-5-(propan-2-yl)-8-(propan-2-yloxy)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC(Oc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C(C)C)C

STK542863
Synonyms: 3-(butylamino)-1-(4-propoxyphenyl)pyrrolidine-2,5-dione
Smiles: CCCCNC1CC(=O)N(C1=O)c1ccc(cc1)OCCC

STK542864
Synonyms: ethyl{[5-oxo-4-(2-phenylethyl)-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CCCC3

STK542865
Synonyms: N-{3-[(4-methylphenyl)sulfonyl]-1-pentyl-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzenesulfonamide
Smiles: CCCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)C

STK542866
Synonyms: 5-[5-(7-chloro-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-8-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1cc2cc3OCCOc3cc2nc1Cl)c1ccccc1

STK542867
Synonyms: (8S,8aR,11aS)-N-(4-chlorophenyl)-10-(2-methoxyphenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Smiles: COc1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)Nc2ccc(cc2)Cl)C=Cc2c1cccc2

STK542868
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-iodo-3-(4-methylphenyl)quinazolin-4(3H)-one
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)cc(cc2)I

STK542869
Synonyms: 4-{[(E)-(2-chloro-7-ethoxyquinolin-3-yl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CCOc1ccc2c(c1)nc(c(c2)/C=N/c1c(C)n(n(c1=O)c1ccccc1)C)Cl

STK542871
Synonyms: 4-(4-chlorophenyl)-N-(3,4-dichlorophenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccc(c(c1)Cl)Cl)cc3c1ccc(cc1)Cl

STK542872
Synonyms: 5-{2-[(2-chlorophenyl)carbonyl]hydrazinyl}-2-ethyl-5-oxopentanoicacid
Smiles: CCC(C(=O)O)CCC(=O)NNC(=O)c1ccccc1Cl

STK542873
Synonyms: 2-[4-(6-bromo-4-phenylquinolin-2-yl)phenoxy]-N'-[(E)-(2-chloro-6-methylquinolin-3-yl)methylidene]acetohydrazide
Smiles: O=C(COc1ccc(cc1)c1nc2ccc(cc2c(c1)c1ccccc1)Br)N/N=C/c1cc2cc(C)ccc2nc1Cl

STK542875
Synonyms: ethyl[(3-ethyl-6-iodo-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nc2ccc(cc2c(=O)n1CC)I

STK542876
Synonyms: 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N'-[(E)-(2,6-dichlorophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1c(Cl)cccc1Cl

STK542877
Synonyms: ethyl1-benzyl-2-{[(4-methylphenyl)sulfonyl]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c(NS(=O)(=O)c2ccc(cc2)C)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK542878
Synonyms: (6aS,6bR,9aS,10R)-10-(1H-benzotriazol-1-ylcarbonyl)-8-(4-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)n1nnc2c1cccc2

STK542881
Synonyms: methyl5-bromo-3-[(2-phenylbutanoyl)amino]-1H-indole-2-carboxylate
Smiles: CCC(c1ccccc1)C(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STK542882
Synonyms: N-(2-methoxyphenyl)-2-{[3-(2-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1ccccc1n1c(SCC(=O)Nc2ccccc2OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK542884
Synonyms: N-(3,5-dichlorophenyl)-10-methyl-8-phenyl-11-(thiophen-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Clc1cc(cc(c1)Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccs2)c(nn1c1ccccc1)C

STK542885
Synonyms: N-(diphenylmethyl)-2-{[3-(3-methylphenyl)-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}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK542886
Synonyms: diphenylmethyl(6aR,6bS,9aR,10S)-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]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)OCO3)C=Cc1c2cccc1)OC(c1ccccc1)c1ccccc1

STK542887
Synonyms: methyl7-(3-bromophenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Smiles: COC(=O)C1=NNC2(C1)CC(=O)N(C2=O)c1cccc(c1)Br

STK542888
Synonyms: 6-{(2E)-2-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]hydrazinyl}[1,2,4]triazolo[4,3-b]pyridazine
Smiles: COc1ccccc1/C=C/C=N/Nc1ccc2n(n1)cnn2

STK542889
Synonyms: N-benzyl-N-[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]acetamide
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)C)Cc1ccccc1

STK542890
Synonyms: ethyl(8R,8aR)-6-amino-8-{2-[(4-chlorobenzyl)oxy]phenyl}-5,7,7-tricyano-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccccc1OCc1ccc(cc1)Cl)C(C(=C2C#N)N)(C#N)C#N

STK542891
Synonyms: 8,8-dimethyl-3-(3-methylphenyl)-2-{[4-(propan-2-yloxy)benzyl]sulfanyl}-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CC(Oc1ccc(cc1)CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1cccc(c1)C)C

STK542892
Synonyms: N-{3-[(4-methylphenyl)sulfonyl]-1-(1-phenylethyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NS(=O)(=O)c2ccccc2)n(c2c1nc1ccccc1n2)C(c1ccccc1)C

STK542893
Synonyms: 2-(ethylsulfanyl)-6-iodo-3-(2-methylphenyl)quinazolin-4(3H)-one
Smiles: CCSc1nc2ccc(cc2c(=O)n1c1ccccc1C)I

STK542894
Synonyms: 3-butyl-11-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cccc(c1)C

STK542895
Synonyms: 11-(2-fluorophenyl)-10-methyl-8-phenyl-N-[3-(trifluoromethyl)phenyl]-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Fc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)C(F)(F)F)c1ccccc1

STK542896
Synonyms: 2-{[6,6-dimethyl-4-oxo-3-(2-phenylethyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(diphenylmethyl)acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)(C)C

STK542897
Synonyms: (4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-[3-(morpholin-4-yl)propyl]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)OC)CCCN1CCOCC1)/O

STK542898
Synonyms: 3-{(Z)-[3-(4-fluorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-{[2-(2-hydroxyethoxy)ethyl]amino}-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: OCCOCCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)F

STK542901
Synonyms: 3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[(2-methylpropyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CC(CNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)C

STK542902
Synonyms: (3E)-5-bromo-3-[2-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)hydrazinylidene]-1,3-dihydro-2H-indol-2-one
Smiles: Brc1ccc2c(c1)/C(=N\Nc1ncnc3c1c1CCCCc1s3)/C(=O)N2

STK542903
Synonyms: 2,2'-(1,3,4-thiadiazole-2,5-diyldisulfanediyl)bis{N'-[(1Z)-1-(2-hydroxyphenyl)ethylidene]acetohydrazide}
Smiles: O=C(CSc1nnc(s1)SCC(=O)N/N=C(\c1ccccc1O)/C)N/N=C(\c1ccccc1O)/C

STK542904
Synonyms: (2E)-1-[5-(4-fluorophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-phenylprop-2-en-1-one
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)F)C(=O)/C=C/c1ccccc1

STK542905
Synonyms: (4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(pyrimidin-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)OC)c1ncccn1)/O

STK542906
Synonyms: N'-[(1Z)-1-(3-bromophenyl)ethylidene]-2-({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccc(cc1)C)N/N=C(\c1cccc(c1)Br)/C

STK542910
Synonyms: N'-{(E)-[4-(benzyloxy)phenyl]methylidene}-2-[4-(4-methylbenzyl)piperazin-1-yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1ccc(cc1)OCc1ccccc1

STK542911
Synonyms: 2-{[6,6-dimethyl-3-(4-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C

STK542912
Synonyms: 6-{(2E)-2-[1-(thiophen-2-yl)ethylidene]hydrazinyl}[1,2,4]triazolo[4,3-b]pyridazine
Smiles: C/C(=N\Nc1ccc2n(n1)cnn2)/c1cccs1

STK542913
Synonyms: 1-hydroxy-3-(3-nitrophenyl)quinoxalin-2(1H)-one4-oxide
Smiles: [O-][N+](=O)c1cccc(c1)c1c(=O)n(O)c2c([n+]1[O-])cccc2

STK542914
Synonyms: ethyl7-(3-methoxyphenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Smiles: CCOC(=O)C1=NNC2(C1)CC(=O)N(C2=O)c1cccc(c1)OC

STK542915
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-bromophenyl)carbonyl]-2-(2-methyl-5-nitrophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Brc1ccc(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

STK542916
Synonyms: 11-(3-bromophenyl)-N-(2-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Br)c(nn1c1ccccc1)C

STK542917
Synonyms: 2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-(4-bromophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK542919
Synonyms: (3aR,6aS)-5-(4-bromophenyl)-3-(3,4-dimethoxyphenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1cc(ccc1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)Br

STK542920
Synonyms: 4-[4-(2,3-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]phenol
Smiles: Oc1ccc(cc1)c1[nH]c(c(n1)c1cccc(c1Cl)Cl)c1ccccc1

STK542921
Synonyms: 2,6-bis(4-fluorophenyl)-3,5-dimethylpiperidin-4-one
Smiles: CC1C(=O)C(C)C(NC1c1ccc(cc1)F)c1ccc(cc1)F

STK542922
Synonyms: 8-chloro-5-(piperidin-1-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: Clc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCCCC1

STK542926
Synonyms: 3-{(Z)-[4-oxo-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(thiomorpholin-4-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCSCC2)/C(=O)N1C(c1ccccc1)C

STK542927
Synonyms: 3-[(Z)-(3-cyclopentyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-7-methyl-2-(4-methylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CN1CCN(CC1)c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCC1)C

STK542928
Synonyms: 2-(4-benzylpiperidin-1-yl)-1-[3,5-bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Smiles: COc1ccc(cc1)C1CC(=NN1C(=O)CN1CCC(CC1)Cc1ccccc1)c1ccc(cc1)OC

STK542929
Synonyms: 2-{[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2-ethoxyphenyl)methylidene]acetohydrazide
Smiles: CCOc1ccccc1/C=N/NC(=O)CSc1nnc(n1CC)c1ccc(c(c1)OC)OC

STK542930
Synonyms: (4E)-4-[hydroxy(4-methylphenyl)methylidene]-1-[3-(1H-imidazol-1-yl)propyl]-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)CCCn1ccnc1)/O

STK542931
Synonyms: (1'R,2'S,3R)-2'-[(4-fluorophenyl)carbonyl]-2-oxo-N-phenyl-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinoline]-1'-carboxamide
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@H](C(=O)Nc2ccccc2)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STK542932
Synonyms: 3-cyclohexyl-2-methyl-11-(4-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C1CCCCC1

STK542933
Synonyms: N-hexyl-2,2-dimethyl-5-(pyrrolidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CCCCCCNc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCCC1

STK542934
Synonyms: 7,9-bis(4-fluorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazoline
Smiles: Fc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)F)c1c(CC2)cccc1

STK542935
Synonyms: N-(4-butylphenyl)-11-(4-ethoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)OCC)C)c1ccccc1

STK542936
Synonyms: N~6~-benzyl-N~4~-hexyl-7-nitro-2,1,3-benzoxadiazole-4,6-diamine
Smiles: CCCCCCNc1cc(NCc2ccccc2)c(c2c1non2)[N+](=O)[O-]

STK542938
Synonyms: phenyl(5-phenyl-1,2-oxazol-3-yl)methanone
Smiles: O=C(c1noc(c1)c1ccccc1)c1ccccc1

STK542940
Synonyms: (4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(3-phenoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2cccc(c2)Oc2ccccc2)N(C(=O)C1=O)c1nnc(s1)C)/O

STK542941
Synonyms: 11-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(c(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)Cl)C)c1ccccc1)OC

STK542944
Synonyms: 8-ethyl-8-methyl-3-(4-methylphenyl)-2-(prop-2-en-1-ylsulfanyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: C=CCSc1nc2nc3CC(C)(CC)OCc3cc2c(=O)n1c1ccc(cc1)C

STK542945
Synonyms: 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-6-(propan-2-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: C/C(=C/CSc1nc(N)c2c(n1)sc1c2CC(OC1)C(C)C)/Cl

STK542946
Synonyms: 4-methyl-N-{[6-(propan-2-yl)-1,3-benzothiazol-2-yl]carbamothioyl}benzamide
Smiles: S=C(NC(=O)c1ccc(cc1)C)Nc1nc2c(s1)cc(cc2)C(C)C

STK542947
Synonyms: 6,6-dimethyl-3-(3-methylphenyl)-2-{[4-(propan-2-yloxy)benzyl]sulfanyl}-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(Oc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(SC3)(C)C)C

STK542948
Synonyms: 4-[1-(6-chloro-4-phenylquinazolin-2-yl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-5-yl]-N,N-dimethylaniline
Smiles: COc1cc(ccc1OC)C1=NN(C(C1)c1ccc(cc1)N(C)C)c1nc2ccc(cc2c(n1)c1ccccc1)Cl

STK542949
Synonyms: N'-[(E)-(2,6-dichlorophenyl)methylidene]-2-{[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)N/N=C/c1c(Cl)cccc1Cl

STK542950
Synonyms: bis(2-methylpropyl)[(benzylamino)(2-fluorophenyl)methyl]phosphonate
Smiles: CC(COP(=O)(C(c1ccccc1F)NCc1ccccc1)OCC(C)C)C

STK542951
Synonyms: 1-[(2-oxo-2-phenylethyl)sulfanyl]-4-(2-phenylethyl)-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(C1OCc2c(C1)c1c(=O)n(CCc3ccccc3)c3n(c1s2)c(SCC(=O)c1ccccc1)nn3)C

STK542952
Synonyms: N-(3-methylphenyl)-2-{[4-oxo-3-(2-phenylethyl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

STK542953
Synonyms: 3-benzyl-2-(ethylsulfanyl)-6-iodoquinazolin-4(3H)-one
Smiles: CCSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)I

STK542956
Synonyms: methyl3-[(benzylcarbamothioyl)amino]-5-bromo-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=S)NCc1ccccc1)cc(cc2)Br

STK542957
Synonyms: 3,6-diamino-N-[4-chloro-3-(trifluoromethyl)phenyl]-5-cyanothieno[2,3-b]pyridine-2-carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)Nc1ccc(c(c1)C(F)(F)F)Cl

STK542958
Synonyms: 3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[4-(2-methoxyphenyl)piperazin-1-yl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2OC)/C1=O)C

STK542959
Synonyms: (3-methylphenyl)(7-methyl-2-thioxo[1,2,4]triazolo[1,5-a]pyridin-3(2H)-yl)methanone
Smiles: Cc1cccc(c1)C(=O)n1c(=S)nc2n1ccc(c2)C

STK542960
Synonyms: 8-benzyl-4-(3-methylphenyl)-1-(methylsulfanyl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCN(C3)Cc1ccccc1

STK542961
Synonyms: N-(3-methoxyphenyl)-2-{[3-(2-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1OC)CCCCC3

STK542962
Synonyms: ethyl(pentafluorophenyl)[phenyl(phenylamino)methyl]phosphinate
Smiles: CCOP(=O)(c1c(F)c(F)c(c(c1F)F)F)C(c1ccccc1)Nc1ccccc1

STK542963
Synonyms: 3-amino-N-(2,6-dimethylphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)CC(CC1=O)(C)C)Nc1c(C)cccc1C

STK542964
Synonyms: 3-(2,5-dibromophenyl)-2-[(E)-2-(2-hydroxyphenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Brc1ccc(c(c1)n1c(/C=C/c2ccccc2O)nc2c(c1=O)cccc2)Br

STK542965
Synonyms: diphenylmethyl(6aR,6bS,9aR,10S)-8-(3,5-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)c1cc(Cl)cc(c1)Cl)OC(c1ccccc1)c1ccccc1

STK542966
Synonyms: N-(4-methoxyphenyl)-2-{[3-(3-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCCC3

STK542967
Synonyms: 2-amino-1-(3,5-dimethylphenyl)-N-pentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK542969
Synonyms: methyl2-(acetylamino)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3,3,3-trifluoroalaninate
Smiles: COC(=O)C(C(F)(F)F)(Nc1sc2c(n1)c(C)cc(c2)C)NC(=O)C

STK542970
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Clc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

STK542971
Synonyms: 2,2'-[(12-ethyl-12-methyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine-3,7-diyl)disulfanediyl]diaceticacid
Smiles: CCC1(C)OCc2c(C1)c1c3nnc(n3c3n(c1s2)c(SCC(=O)O)nn3)SCC(=O)O

STK542972
Synonyms: 2-oxo-N-(1-phenylethyl)-2H-pyran-5-carboxamide
Smiles: O=c1ccc(co1)C(=O)NC(c1ccccc1)C

STK542973
Synonyms: 2-amino-1-(4-fluorobenzyl)-N-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Fc1ccc(cc1)Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccccc1

STK542974
Synonyms: N'-[(E)-(2,4-dichlorophenyl)methylidene]-2-[4-(4-methylbenzyl)piperazin-1-yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1ccc(cc1Cl)Cl

STK542975
Synonyms: (3aS,6aS)-3-(4-bromophenyl)-5-(2-fluorophenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Smiles: Brc1ccc(cc1)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1F)c1ccccc1

STK542976
Synonyms: 1-amino-N-(furan-2-ylmethyl)-8,8-dimethyl-5-(morpholin-4-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1)NCc1ccco1

STK542977
Synonyms: N-{2-[(1-bromonaphthalen-2-yl)oxy]-5-chlorophenyl}-4-chlorobenzamide
Smiles: Clc1ccc(c(c1)NC(=O)c1ccc(cc1)Cl)Oc1ccc2c(c1Br)cccc2

STK542978
Synonyms: ethyl2-{[({5-[5-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)pentyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(o2)CCCCCn2c(=O)c3cccc4c3c(c2=O)ccc4)sc(c1C)C

STK542979
Synonyms: 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N'-[(E)-(3-methylphenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1cccc(c1)C

STK542980
Synonyms: 3,7-bis[(4-methoxybenzyl)sulfanyl]-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
Smiles: COc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c1n2c(SCc2ccc(cc2)OC)nn1)CCCC3

STK542981
Synonyms: 8-ethyl-8-methyl-3-(4-methylphenyl)-2-{[4-(propan-2-yloxy)benzyl]sulfanyl}-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)nc1c(c2)c(=O)n(c(n1)SCc1ccc(cc1)OC(C)C)c1ccc(cc1)C

STK542982
Synonyms: diethyl[(4-chlorophenyl)(phenylamino)methyl]phosphonate
Smiles: CCOP(=O)(C(c1ccc(cc1)Cl)Nc1ccccc1)OCC

STK542984
Synonyms: diphenylmethyl(8S,8aR,11aS)-10-(naphthalen-1-yl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxylate
Smiles: O=C([C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc2c1cccc2)cccc3)OC(c1ccccc1)c1ccccc1

STK542985
Synonyms: ethyl(1-{3-[(Z)-(3-cyclopentyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}-3-oxopiperazin-2-yl)acetate
Smiles: CCOC(=O)CC1C(=O)NCCN1c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCC1

STK542986
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-bromophenyl)carbonyl]-2-(3,5-dichlorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Brc1ccc(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

STK542990
Synonyms: 1-[4-(2-methylpropoxy)benzyl]thiourea
Smiles: CC(COc1ccc(cc1)CNC(=S)N)C

STK542991
Synonyms: 6-iodo-3-(2-methylphenyl)-2-[(2-phenylethyl)sulfanyl]quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)SCCc1ccccc1)c1ccccc1C

STK542992
Synonyms: 2-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: C/C(=C\CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CCCC3)/Cl

STK542993
Synonyms: (7E)-3-(4-bromophenyl)-7-(furan-2-ylmethylidene)-2-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazole
Smiles: Brc1ccc(cc1)C1C2CCC/C(=C\c3ccco3)/C2=NN1c1ccccc1

STK542994
Synonyms: 1,1'-(4,5-dihydrofuran-3-ylphosphorothioyl)dipiperidine
Smiles: S=P(C1=COCC1)(N1CCCCC1)N1CCCCC1

STK542996
Synonyms: 1-benzyl-N-(4-fluorophenyl)-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1c(O)c2CCCCc2n(c1=O)Cc1ccccc1

STK542997
Synonyms: 3-amino-2-(4-methoxyphenyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COc1ccc(cc1)c1nc2sc3c(c2c(=O)n1N)CC(OC3)(C)C

STK542999
Synonyms: (8S,8aR,11aS,11bS)-10-(2-chloro-5-nitrophenyl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: O=C([C@@H]1[C@H]2[C@@H]([C@@H]3N1C=Cc1c3cccc1)C(=O)N(C2=O)c1cc(ccc1Cl)[N+](=O)[O-])c1ccccc1

STK543001
Synonyms: 3,6-diamino-N-[4-bromo-3-(trifluoromethyl)phenyl]-5-cyanothieno[2,3-b]pyridine-2-carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)Nc1ccc(c(c1)C(F)(F)F)Br

STK543004
Synonyms: 4-tert-butyl-2'-(2-chlorophenyl)-7'-methoxy-1',10b'-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: COc1cccc2c1OC1(CCC(CC1)C(C)(C)C)N1C2CC(=N1)c1ccccc1Cl

STK543005
Synonyms: 3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[(2-methoxyethyl)amino]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: COCCNc1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCOCC)C

STK543007
Synonyms: 4-chloro-N-{2-[methyl(phenyl)amino]-1,2-dihydroacenaphthylen-1-yl}benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)NC1c2cccc3c2c(C1N(c1ccccc1)C)ccc3

STK543008
Synonyms: N'-[(1E)-1-(naphthalen-1-yl)ethylidene]pyrazine-2-carbohydrazide
Smiles: C/C(=N\NC(=O)c1cnccn1)/c1cccc2c1cccc2

STK543010
Synonyms: (8S,8aR,11aS)-10-(4-bromophenyl)-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)c1ccc(cc1)Br)cccc3

STK543011
Synonyms: diphenylmethyl(8S,8aR,11aS)-9,11-dioxo-10-[3-(trifluoromethyl)phenyl]-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxylate
Smiles: O=C([C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F)cccc3)OC(c1ccccc1)c1ccccc1

STK543012
Synonyms: 9-benzyl-2-(pyridin-4-yl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: c1ccc(cc1)CN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1ccncc1

STK543013
Synonyms: (2E)-1-[3-(4-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-phenylprop-2-en-1-one
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)C)C(=O)/C=C/c1ccccc1

STK543017
Synonyms: 2-[4-(2-chlorobenzyl)piperazin-1-yl]-N'-[(1E)-1-(4-chlorophenyl)ethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1Cl)N/N=C(/c1ccc(cc1)Cl)\C

STK543018
Synonyms: (4S,4aR)-2-amino-6-tert-butyl-4-(3,4-difluorophenyl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCC(C2)C(C)(C)C)c1ccc(c(c1)F)F)(C#N)C#N

STK543019
Synonyms: N'-[(E)-(5-bromothiophen-2-yl)methylidene]-2-[4-(4-methylbenzyl)piperazin-1-yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1ccc(s1)Br

STK543020
Synonyms: ethyl3-[(cyclohexylcarbamothioyl)amino]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=S)NC1CCCCC1)cccc2

STK543021
Synonyms: ethyl3-[(cyclohexylcarbamoyl)amino]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)NC1CCCCC1)cccc2

STK543022
Synonyms: 9-[(3-bromobenzyl)sulfanyl]-8-cyclohexyl-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: Brc1cccc(c1)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCc1c3cccc1

STK543023
Synonyms: 4-chloro-N-{2-[4-(phenylcarbonyl)piperazin-1-yl]-1,2-dihydroacenaphthylen-1-yl}benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)NC1C(N2CCN(CC2)C(=O)c2ccccc2)c2c3c1cccc3ccc2

STK543026
Synonyms: (4-methylphenyl)(7-methyl-2-thioxo[1,2,4]triazolo[1,5-a]pyridin-3(2H)-yl)methanone
Smiles: Cc1ccc(cc1)C(=O)n1c(=S)nc2n1ccc(c2)C

STK543028
Synonyms: 2-{[4,5-bis(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C)N/N=C/c1c(C)nn(c1C)c1ccccc1

STK543030
Synonyms: (4E)-4-[hydroxy(4-methylphenyl)methylidene]-5-phenyl-1-(pyridin-4-ylmethyl)pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)Cc1ccncc1)/O

STK543031
Synonyms: 3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-7-methyl-2-(4-methylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)C)/C1=O

STK543032
Synonyms: [3-(4-bromophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl](2-fluorophenyl)methanone
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)c1ccccc1F

STK543034
Synonyms: 2-{[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]acetohydrazide
Smiles: CCn1c(SCC(=O)N/N=C/c2cc(OC)c(c(c2)OC)OC)nnc1c1ccc(c(c1)OC)OC

STK543035
Synonyms: N-{1-[1-(3-methylbutyl)-1H-benzimidazol-2-yl]-2-phenylethyl}benzamide
Smiles: CC(CCn1c(nc2c1cccc2)C(NC(=O)c1ccccc1)Cc1ccccc1)C

STK543036
Synonyms: 6,7-dimethoxy-2-phenyl-4-(thiomorpholin-4-yl)quinazoline
Smiles: COc1cc2nc(nc(c2cc1OC)N1CCSCC1)c1ccccc1

STK543037
Synonyms: 6-chloro-7-[(4-chlorobenzyl)oxy]-3-(2-hydroxypropyl)-4-methyl-2H-chromen-2-one
Smiles: CC(Cc1c(=O)oc2c(c1C)cc(c(c2)OCc1ccc(cc1)Cl)Cl)O

STK543038
Synonyms: methyl5-bromo-3-[(cyclopropylcarbonyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C1CC1)cc(cc2)Br

STK543039
Synonyms: 2-(2,6-dimethylmorpholin-4-yl)-3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCOCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CC(C)OC(C2)C)/C1=O

STK543040
Synonyms: N-(4-bromophenyl)-2-{[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK543041
Synonyms: 2-[(E)-2-(2-chlorophenyl)ethenyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(/C=C/c2ccccc2Cl)nc2c(c1=O)cc(cc2)I

STK543042
Synonyms: N-(4-bromophenyl)-2-{[4-oxo-3-(2-phenylethyl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

STK543043
Synonyms: (4E)-5-(4-ethoxy-3-methoxyphenyl)-4-{hydroxy[3-methyl-4-(2-methylpropoxy)phenyl]methylidene}-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OCC(C)C)/O)/C1c1ccc(c(c1)OC)OCC

STK543044
Synonyms: 2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N'-[(E)-(2-nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccccc1)N/N=C/c1ccccc1[N+](=O)[O-]

STK543045
Synonyms: 8,8-dimethyl-3-(4-methylphenyl)-2-(prop-2-en-1-ylsulfanyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: C=CCSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)C

STK543047
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[1-(3-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]propanamide
Smiles: CCOc1cccc(c1)N1C(=O)CC(C1=O)N(C(=O)CC)CCc1ccc(c(c1)OC)OC

STK543048
Synonyms: 2-[(E)-2-(4-fluorophenyl)ethenyl]-3-(2-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccccc1n1c(/C=C/c2ccc(cc2)F)nc2c(c1=O)cccc2

STK543050
Synonyms: 2-{[(4-chlorophenyl)sulfonyl]amino}-1-(4-methoxybenzyl)-N-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(cc1)Cn1c(NS(=O)(=O)c2ccc(cc2)Cl)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccccc1

STK543051
Synonyms: 4-(dimethylamino)-6-methyl-2-(morpholin-4-yl)pyridine-3-carbonitrile
Smiles: N#Cc1c(nc(cc1N(C)C)C)N1CCOCC1

STK543052
Synonyms: 2-(2,6-dichlorophenyl)-5-(2-methyl-5-nitrophenyl)-4-phenyl-1H-imidazole
Smiles: Cc1ccc(cc1c1[nH]c(nc1c1ccccc1)c1c(Cl)cccc1Cl)[N+](=O)[O-]

STK543053
Synonyms: 3-(3-methylphenyl)-6-(propan-2-yl)-2-{[4-(propan-2-yloxy)benzyl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Cc1cccc(c1)n1c(SCc2ccc(cc2)OC(C)C)nc2c(c1=O)c1CC(OCc1s2)C(C)C

STK543054
Synonyms: 2-(4-nitrophenyl)-1-phenyl-1H-imidazo[4,5-b]quinoxaline
Smiles: [O-][N+](=O)c1ccc(cc1)c1nc2c(n1c1ccccc1)nc1c(n2)cccc1

STK543055
Synonyms: N,1-bis(furan-2-ylmethyl)-2-{[(4-methylphenyl)sulfonyl]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1c(C(=O)NCc2ccco2)c2c(n1Cc1ccco1)nc1c(n2)cccc1

STK543056
Synonyms: ethyl5-methoxy-3-{[(4-methoxyphenyl)carbamoyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)Nc1ccc(cc1)OC)cc(cc2)OC

STK543057
Synonyms: 9-(butylsulfanyl)-8-(2-ethoxyphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1OCC)CCc1c3cccc1

STK543058
Synonyms: N-benzyl-2-[(4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)sulfanyl]acetamide
Smiles: O=C(CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1)NCc1ccccc1

STK543059
Synonyms: (4E)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(3-methoxypropyl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccc(cc1)C

STK543060
Synonyms: N-{4-[(1-bromonaphthalen-2-yl)oxy]-3-chlorophenyl}acridin-9-amine
Smiles: Clc1cc(ccc1Oc1ccc2c(c1Br)cccc2)Nc1c2ccccc2nc2c1cccc2

STK543061
Synonyms: diethyl(6Z)-2-[4-(dimethylamino)phenyl]-4-hydroxy-6-(hydroxyimino)-4-methylcyclohexane-1,3-dicarboxylate
Smiles: CCOC(=O)C1/C(=N\O)/CC(C(C1c1ccc(cc1)N(C)C)C(=O)OCC)(C)O

STK543063
Synonyms: N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)NC(=N)N

STK543064
Synonyms: 1-amino-8,8-dimethyl-N-(3-methylphenyl)-5-(morpholin-4-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK543065
Synonyms: 4-methyl-N-{3-phenyl-3-[4-(propan-2-yloxy)phenyl]propyl}benzenesulfonamide
Smiles: CC(Oc1ccc(cc1)C(c1ccccc1)CCNS(=O)(=O)c1ccc(cc1)C)C

STK543066
Synonyms: N'-[(E)-1H-indol-3-ylmethylidene]-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C)N/N=C/c1c[nH]c2c1cccc2

STK543067
Synonyms: 2-{[6,6-dimethyl-3-(4-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N,N-diethylacetamide
Smiles: CCN(C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C)CC

STK543068
Synonyms: N-(4-acetylphenyl)-2-[(5-ethoxy-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]acetamide
Smiles: CCOc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)C(=O)C)nn2)CC(OC3)(C)C

STK543069
Synonyms: 2-[(3-ethyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(4-methylphenyl)acetamide
Smiles: CCc1c(=O)oc2c(c1C)ccc(c2)OCC(=O)Nc1ccc(cc1)C

STK543071
Synonyms: N-(2,5-dimethylphenyl)-10-methyl-8-phenyl-11-(thiophen-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1ccc(c(c1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccs2)c(nn1c1ccccc1)C)C

STK543072
Synonyms: [1-amino-8,8-dimethyl-5-(morpholin-4-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridin-2-yl](3-nitrophenyl)methanone
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1)c1cccc(c1)[N+](=O)[O-]

STK543073
Synonyms: (2Z)-N-(2-{(2E)-2-[1-(2,4-dimethoxyphenyl)ethylidene]hydrazinyl}-2-oxoethyl)-3-(4-methoxyphenyl)prop-2-enamide(non-preferredname)
Smiles: COc1ccc(cc1)/C=C\C(=O)NCC(=O)N/N=C(/c1ccc(cc1OC)OC)\C

STK543074
Synonyms: 1-amino-8,8-dimethyl-5-(morpholin-4-yl)-N-(2-nitrophenyl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1)Nc1ccccc1[N+](=O)[O-]

STK543075
Synonyms: methyl5-chloro-3-({2-[4-(2-hydroxyethyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
Smiles: OCCN1CCN(CC1)C(C(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC)C

STK543076
Synonyms: 2-{[6,6-dimethyl-4-oxo-3-(2-phenylethyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)(C)C

STK543078
Synonyms: 2-({2-oxo-2-[(2-{[2-oxo-2-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)amino]ethyl}sulfanyl)-N-phenylacetamide
Smiles: O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)n1c2CCCCc2c2c1cccc2)CSCC(=O)Nc1ccccc1

STK543079
Synonyms: 2-[(6,6-dimethyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(furan-2-ylmethyl)acetamide
Smiles: O=C(NCc1ccco1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(SC3)(C)C

STK543080
Synonyms: 6-iodo-2-[(2-phenylethyl)sulfanyl]-3-(prop-2-en-1-yl)quinazolin-4(3H)-one
Smiles: C=CCn1c(SCCc2ccccc2)nc2c(c1=O)cc(cc2)I

STK543081
Synonyms: 2-[4-(4-chlorobenzyl)piperazin-1-yl]-N'-[(1E)-3-phenylprop-2-en-1-ylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/C=C/c1ccccc1

STK543082
Synonyms: 5-(ethylsulfanyl)-3-[(4-methoxybenzyl)sulfanyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)OC)nn2)CCCC3

STK543083
Synonyms: 2-{[7-benzyl-3-(3-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(2,4-dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCN(C3)Cc1ccccc1

STK543085
Synonyms: N-[1-(1-hexyl-1H-benzimidazol-2-yl)ethyl]benzamide
Smiles: CCCCCCn1c(nc2c1cccc2)C(NC(=O)c1ccccc1)C

STK543086
Synonyms: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)CCO)/C1=O

STK543087
Synonyms: 2-[4-(3-chlorophenyl)piperazin-1-yl]-1-(8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)ethanone
Smiles: COc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)CN1CCN(CC1)c1cccc(c1)Cl

STK543088
Synonyms: (4Z)-4-(1-hydroxyethylidene)-5-(3-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\O)/C)/C(N1c1cccc(c1)C(F)(F)F)c1cccc(c1)[N+](=O)[O-]

STK543089
Synonyms: 2-amino-1-(4-fluorobenzyl)-N-pentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)F

STK543090
Synonyms: (3aR,6aS)-5-(4-methoxyphenyl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccc(cc1)[N+](=O)[O-]

STK543091
Synonyms: 4-phenyl-7-(piperidin-1-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: C1CCN(CC1)c1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK543092
Synonyms: 2-[(2,4-dichlorobenzyl)sulfanyl]-3-(3-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1cccc(c1)n1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK543095
Synonyms: (3aS,6aS)-3,5-bis(4-bromophenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Smiles: Brc1ccc(cc1)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1

STK543096
Synonyms: ethyl{[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)OC)CCCC3

STK543100
Synonyms: (3aR,6aS)-3-(4-bromophenyl)-5-(2,4-dichlorophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: Brc1ccc(cc1)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1Cl)Cl

STK543101
Synonyms: N-{2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-3-phenylpropanamide
Smiles: N#Cc1c(sc(c1CC)C)NC(C(F)(F)F)(C(F)(F)F)NC(=O)CCc1ccccc1

STK543102
Synonyms: N'-[(1E)-1-(3-methoxyphenyl)ethylidene]pyrazine-2-carbohydrazide
Smiles: COc1cccc(c1)/C(=N/NC(=O)c1cnccn1)/C

STK543103
Synonyms: 4-(2,3-dichlorophenyl)-2-(2,5-dimethoxyphenyl)-5-phenyl-1H-imidazole
Smiles: COc1ccc(c(c1)c1[nH]c(c(n1)c1cccc(c1Cl)Cl)c1ccccc1)OC

STK543104
Synonyms: 3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-(thiomorpholin-4-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCOCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCSCC2)/C1=O

STK543106
Synonyms: N-(4-bromophenyl)-2-{[8,8-dimethyl-3-(3-methylphenyl)-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1cccc(c1)C

STK543107
Synonyms: 2-[4-(4-chlorobenzyl)piperazin-1-yl]-N'-[(E)-1H-indol-3-ylmethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1c[nH]c2c1cccc2

STK543108
Synonyms: (6aR,6bS,9aR,10S)-8-(4-acetylphenyl)-10-[(4-bromophenyl)carbonyl]-2-chloro-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1[C@H]2[C@@H]([C@@H]3N1c1cc(Cl)ccc1C=C3)C(=O)N(C2=O)c1ccc(cc1)C(=O)C

STK543109
Synonyms: 1-(benzyloxy)-3-(4-ethoxyphenyl)quinoxalin-2(1H)-one4-oxide
Smiles: CCOc1ccc(cc1)c1c(=O)n(OCc2ccccc2)c2c([n+]1[O-])cccc2

STK543110
Synonyms: 2-{[2-(2-hydroxyethoxy)ethyl]amino}-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(NCCOCCO)nc3n(c2=O)cccc3)/C1=O

STK543111
Synonyms: 2-(1,3-benzoxazol-2-ylsulfanyl)-N'-[(1Z)-1-(3,4-dichlorophenyl)ethylidene]acetohydrazide
Smiles: O=C(N/N=C(\c1ccc(c(c1)Cl)Cl)/C)CSc1nc2c(o1)cccc2

STK543115
Synonyms: 5-(morpholin-4-yl)-4-nitro-7-(piperidin-1-yl)-2,1,3-benzoxadiazole
Smiles: [O-][N+](=O)c1c(cc(c2c1non2)N1CCCCC1)N1CCOCC1

STK543117
Synonyms: 2-[(3'-cyano-1'H-spiro[cyclohexane-1,2'-naphthalen]-4'-yl)amino]-2-oxoethylN,N-diphenylcarbamimidothioate
Smiles: N#CC1=C(NC(=O)CSC(=N)N(c2ccccc2)c2ccccc2)c2ccccc2CC21CCCCC2

STK543118
Synonyms: (4S,4aR)-2-amino-6-tert-butyl-4-(3,4-diethoxyphenyl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: CCOc1cc(ccc1OCC)[C@@H]1[C@H]2CC(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(C)(C)C

STK543119
Synonyms: (6aR,6bS,9aR,10S)-8-(3-chlorophenyl)-7,9-dioxo-N-phenyl-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxamide
Smiles: Clc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccccc1

STK543120
Synonyms: (4E)-5-(4-bromophenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccc(cc1)Br

STK543121
Synonyms: [3-(4-bromophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl](4-chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)N1N=C(CC1c1ccco1)c1ccc(cc1)Br

STK543122
Synonyms: 11-(3-chlorophenyl)-3-phenyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Clc1cccc(c1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)c1ccccc1

STK543124
Synonyms: 2,2-dimethyl-5-(pyrrolidin-1-yl)-N-(tetrahydrofuran-2-ylmethyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CC1(C)OCc2c(C1)c1c(nc2N2CCCC2)sc2c1ncnc2NCC1CCCO1

STK543125
Synonyms: 2-[(4-methoxybenzyl)sulfanyl]-3-(3-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK543126
Synonyms: [(6-methoxy-2-methylquinolin-4-yl)sulfanyl]aceticacid
Smiles: COc1ccc2c(c1)c(SCC(=O)O)cc(n2)C

STK543127
Synonyms: 1-(3-chlorophenyl)-3-[(2-phenylethyl)amino]pyrrolidine-2,5-dione
Smiles: Clc1cccc(c1)N1C(=O)CC(C1=O)NCCc1ccccc1

STK543128
Synonyms: 2-[4-(6-bromo-4-phenylquinolin-2-yl)phenoxy]-N'-[(E)-(2-chloro-7-methoxyquinolin-3-yl)methylidene]acetohydrazide
Smiles: COc1ccc2c(c1)nc(c(c2)/C=N/NC(=O)COc1ccc(cc1)c1nc2ccc(cc2c(c1)c1ccccc1)Br)Cl

STK543129
Synonyms: N-methyl-N-phenyl-2-[(10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Smiles: CN(c1ccccc1)C(=O)CSc1nnc2n1cnc1c2sc2c1c1CCCc1c(n2)c1ccccc1

STK543130
Synonyms: 2-{[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: COc1cccc(c1)n1c(SCC(=O)Nc2ccc(cc2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK543131
Synonyms: 3-benzyl-6-iodo-2-[(Z)-(5-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/1\C(=O)Nc2c1cc(C)cc2)Cc1ccccc1

STK543132
Synonyms: (1Z)-N-[(9-benzyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]-1-(3,4-dimethoxyphenyl)ethanimine
Smiles: COc1cc(ccc1OC)/C(=N\OCc1nn2c(n1)c1c(nc2)sc2c1CCN(C2)Cc1ccccc1)/C

STK543133
Synonyms: (8E)-2-amino-8-(4-ethoxybenzylidene)-4-(4-ethoxyphenyl)-6-(propan-2-yl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Smiles: CCOc1ccc(cc1)/C=C/1\CN(CC2=C1OC(=C(C2c1ccc(cc1)OCC)C#N)N)C(C)C

STK543134
Synonyms: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6,7-dimethoxy-2-phenylquinazoline
Smiles: COc1cc2nc(nc(c2cc1OC)N1CCN(CC1)c1cccc(c1C)C)c1ccccc1

STK543137
Synonyms: 7-(4-methylphenyl)-7,9,10,11-tetrahydrobenzo[c]acridin-8-ol
Smiles: Cc1ccc(cc1)C1C2=C(O)CCCC2=Nc2c1ccc1c2cccc1

STK543139
Synonyms: (3aS,6aS)-3-(4-nitrophenyl)-1-phenyl-5-[3-(trifluoromethyl)phenyl]-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Smiles: O=C1[C@@H]2C(=NN([C@@H]2C(=O)N1c1cccc(c1)C(F)(F)F)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK543140
Synonyms: 3-(2-chloroethyl)-6-methyl-2-(methylsulfanyl)pyrimidin-4(3H)-one
Smiles: CSc1nc(C)cc(=O)n1CCCl

STK543141
Synonyms: 2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-8,8-dimethyl-8,9-dihydro-6H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-amine
Smiles: Nc1nc(SCc2ccc3c(c2)OCO3)nc2c1cc1COC(Cc1n2)(C)C

STK543143
Synonyms: 4-{(E)-[2-(6-chloro-1,3-benzoxazol-2-yl)hydrazinylidene]methyl}-N,N-dimethylaniline
Smiles: Clc1ccc2c(c1)oc(n2)N/N=C/c1ccc(cc1)N(C)C

STK543144
Synonyms: 2-(hexylsulfanyl)-3-(3-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)OC)CCCC3

STK543147
Synonyms: 2,5-dichloro-N-{3-[(3,5-dichlorophenyl)amino]quinoxalin-2-yl}benzenesulfonamide
Smiles: Clc1cc(Cl)cc(c1)Nc1nc2ccccc2nc1NS(=O)(=O)c1cc(Cl)ccc1Cl

STK543148
Synonyms: 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N'-[(E)-pyridin-4-ylmethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1ccncc1

STK543149
Synonyms: 3-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-5,10,10-trimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Cc1nc2sc3c(c2c2n1c(SCc1ccc4c(c1)OCO4)nn2)CC(OC3)(C)C

STK543151
Synonyms: 6-nitro-2-oxo-2H-chromene-3-carbonitrile
Smiles: N#Cc1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK543152
Synonyms: 5-(1,3-benzodioxol-5-yl)-2-phenyl-5,6-dihydro-7H-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one
Smiles: O=C1CC(Sc2n1nc(n2)c1ccccc1)c1ccc2c(c1)OCO2

STK543153
Synonyms: 2-{[(4-fluorophenyl)sulfonyl]amino}-1-(4-methoxybenzyl)-N-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(cc1)Cn1c(NS(=O)(=O)c2ccc(cc2)F)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccccc1

STK543154
Synonyms: methyl5-bromo-3-[(ethylcarbamothioyl)amino]-1H-indole-2-carboxylate
Smiles: CCNC(=S)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STK543155
Synonyms: 11-(4-chlorophenyl)-N-(3,4-dichlorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Clc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)Cl)c1ccccc1

STK543156
Synonyms: N'-[(E)-(3,4-dichlorophenyl)methylidene]-2-[4-(4-methylbenzyl)piperazin-1-yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1ccc(c(c1)Cl)Cl

STK543157
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodo-3-(4-methylphenyl)quinazolin-4(3H)-one
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)cc(cc2)I

STK543158
Synonyms: 3-(4-bromophenyl)-6-iodo-2-[(E)-2-(3-methylphenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Brc1ccc(cc1)n1c(/C=C/c2cccc(c2)C)nc2c(c1=O)cc(cc2)I

STK543160
Synonyms: methyl5-fluoro-3-{[(4-fluorophenyl)carbamothioyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=S)Nc1ccc(cc1)F)cc(cc2)F

STK543161
Synonyms: 2-amino-N-(4-fluorobenzyl)-1-[2-(4-methoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(cc1)CCn1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccc(cc1)F

STK543162
Synonyms: N-[2-(1H-benzimidazol-2-yl)propan-2-yl]-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)NC(c1nc2c([nH]1)cccc2)(C)C

STK543164
Synonyms: (3aR,6aS)-5-(2-methoxyphenyl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)ON=C2c1ccc(cc1)[N+](=O)[O-]

STK543165
Synonyms: (2E)-2-[(2-methylphenyl)imino]-6-nitro-2H-1,3-benzothiazin-4-ol
Smiles: Cc1ccccc1/N=c/1\nc(O)c2c(s1)ccc(c2)[N+](=O)[O-]

STK543166
Synonyms: 9'-bromo-2'-(4-bromophenyl)-1-propyl-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: CCCN1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1ccc(cc1)Br)Br

STK543167
Synonyms: (Z)-N-[(9-benzyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]-1-(4-methoxyphenyl)methanimine
Smiles: COc1ccc(cc1)/C=N\OCc1nn2c(n1)c1c(nc2)sc2c1CCN(C2)Cc1ccccc1

STK543168
Synonyms: 3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-{[3-(morpholin-4-yl)propyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: COCCCN1C(=S)S/C(=C\c2c(NCCCN3CCOCC3)nc3n(c2=O)cccc3)/C1=O

STK543169
Synonyms: 2-({2-[2-(8-methyl-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-2-oxoethyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}methyl)-1H-isoindole-1,3(2H)-dione
Smiles: Cc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)CN1CCc2c(C1CN1C(=O)c3c(C1=O)cccc3)cccc2

STK543170
Synonyms: 1-(4-ethylphenyl)-3-[(1-phenylethyl)amino]pyrrolidine-2,5-dione
Smiles: CCc1ccc(cc1)N1C(=O)CC(C1=O)NC(c1ccccc1)C

STK543171
Synonyms: 3-ethyl-6-iodo-2-(methylsulfanyl)quinazolin-4(3H)-one
Smiles: CSc1nc2ccc(cc2c(=O)n1CC)I

STK543172
Synonyms: 1-(4-methylphenyl)-4-phenyl-N-(prop-2-en-1-yl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: C=CCNC(=S)c1c(c2ccc(cc2)C)c2c3n1cc(n3CCCC2)c1ccccc1

STK543173
Synonyms: 5-(3-bromophenyl)-4-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1n1c(=S)[nH]nc1c1cccc(c1)Br

STK543175
Synonyms: N-{1-[1-(2,6-dichlorobenzyl)-1H-benzimidazol-2-yl]-3-(methylsulfanyl)propyl}benzamide
Smiles: CSCCC(c1nc2c(n1Cc1c(Cl)cccc1Cl)cccc2)NC(=O)c1ccccc1

STK543176
Synonyms: 11-(5-bromofuran-2-yl)-N-(4-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(o2)Br)c(nn1c1ccccc1)C

STK543177
Synonyms: 4-methoxy-N'-(3,3,6,7-tetramethyl-3,4-dihydroisoquinolin-1-yl)benzohydrazide
Smiles: COc1ccc(cc1)C(=O)NNC1=NC(C)(C)Cc2c1cc(C)c(c2)C

STK543178
Synonyms: 11-(2-methoxyphenyl)-10-methyl-8-phenyl-N-[3-(trifluoromethyl)phenyl]-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)C(F)(F)F)c1ccccc1

STK543179
Synonyms: methyl2-{[({5-[5-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)pentyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetyl]amino}benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CSc1nnc(o1)CCCCCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK543180
Synonyms: 1-[3-(4-bromophenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-(piperidin-1-yl)propan-1-one
Smiles: COc1ccc(cc1)C1CC(=NN1C(=O)CCN1CCCCC1)c1ccc(cc1)Br

STK543181
Synonyms: N-benzyl-2-{[4-oxo-3-(2-phenylethyl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3)NCc1ccccc1

STK543183
Synonyms: (2-bromophenyl)[3-(6-chloro-2-methyl-4-phenylquinolin-3-yl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Smiles: Clc1ccc2c(c1)c(c1ccccc1)c(c(n2)C)C1=NN(C(C1)c1ccccc1F)C(=O)c1ccccc1Br

STK543184
Synonyms: 8,8-dimethyl-3-(4-methylphenyl)-2-{[4-(propan-2-yloxy)benzyl]sulfanyl}-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CC(Oc1ccc(cc1)CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)C)C

STK543185
Synonyms: N-methyl-2-{[4-oxo-3-(2-phenylethyl)-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: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)CCc1ccccc1)SCC(=O)N(c1ccccc1)C)C

STK543186
Synonyms: N-(4-{[(2E)-2-(2-methoxybenzylidene)hydrazinyl]carbonyl}phenyl)benzamide
Smiles: COc1ccccc1/C=N/NC(=O)c1ccc(cc1)NC(=O)c1ccccc1

STK543187
Synonyms: 4-(4-ethoxyphenyl)-5-(4-fluorophenyl)-3-(4-methylphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: CCOc1ccc(cc1)C1N(c2ccc(cc2)F)C(=O)c2c1c([nH]n2)c1ccc(cc1)C

STK543188
Synonyms: 4-{[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl](propyl)amino}-4-oxobutanoicacid
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)CCC(=O)O)CCC

STK543190
Synonyms: (8S,8aR,11aS)-N-(4-chlorophenyl)-10-(4-methylphenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)Nc2ccc(cc2)Cl)C=Cc2c1cccc2

STK543191
Synonyms: 3,5-dimethyl-2,6-bis(3-methylphenyl)piperidin-4-one
Smiles: O=C1C(C)C(NC(C1C)c1cccc(c1)C)c1cccc(c1)C

STK543192
Synonyms: N'-[(E)-(2-ethoxyphenyl)methylidene]-2-[4-(4-methylbenzyl)piperazin-1-yl]acetohydrazide
Smiles: CCOc1ccccc1/C=N/NC(=O)CN1CCN(CC1)Cc1ccc(cc1)C

STK543193
Synonyms: 2-[4-(3-chlorophenyl)piperazin-1-yl]-1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)ethanone
Smiles: Clc1cccc(c1)N1CCN(CC1)CC(=O)N1CCc2c(C1)c1ccccc1[nH]2

STK543194
Synonyms: N-benzyl-2-{[(4-methylphenyl)sulfonyl]amino}-1-phenyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1c(C(=O)NCc2ccccc2)c2c(n1c1ccccc1)nc1c(n2)cccc1

STK543195
Synonyms: (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-[(4-bromophenyl)carbonyl]-2-chloro-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Clc1ccc2c(c1)N1[C@H](C=C2)[C@@H]2[C@H]([C@H]1C(=O)c1ccc(cc1)Br)C(=O)N(C2=O)c1ccc2c(c1)OCO2

STK543196
Synonyms: [3-(4-chlorophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl](2-fluorophenyl)methanone
Smiles: Clc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)c1ccccc1F

STK543197
Synonyms: N-butyl-2-cyano-2-[3-(dibutylamino)quinoxalin-2-yl]acetamide
Smiles: CCCCNC(=O)C(c1nc2ccccc2nc1N(CCCC)CCCC)C#N

STK543198
Synonyms: 6-chloro-2-[5-(furan-2-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-phenylquinazoline
Smiles: Clc1ccc2c(c1)c(nc(n2)N1N=C(CC1c1ccco1)c1ccccc1)c1ccccc1

STK543200
Synonyms: N-(3,5-dimethylphenyl)-10-methyl-8,11-diphenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1cc(cc(c1)C)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1)C)c1ccccc1

STK543201
Synonyms: 1-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(piperidin-1-yl)ethanone
Smiles: Fc1ccc(cc1)C1CC(=NN1C(=O)CN1CCCCC1)c1cccs1

STK543202
Synonyms: 2-{[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(c(n1)c1ccc(cc1)C)c1ccc(cc1)C

STK543205
Synonyms: 2-{3-[(3aS,6aS)-5-(3,5-dichlorophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazol-3-yl]-3-oxopropyl}-1H-isoindole-1,3(2H)-dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)[C@H]2[C@@H](C1=O)NN=C2C(=O)CCN1C(=O)c2c(C1=O)cccc2

STK543206
Synonyms: 2'-(2,5-dimethylphenyl)-7'-methoxy-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: COc1cccc2c1OC1(CCN(CC1)C(C)C)N1C2CC(=N1)c1cc(C)ccc1C

STK543207
Synonyms: 2-(hexylsulfanyl)-3-(3-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK543208
Synonyms: N-(4-{[4-(4-nitrophenyl)piperazin-1-yl]acetyl}phenyl)benzenesulfonamide
Smiles: O=C(c1ccc(cc1)NS(=O)(=O)c1ccccc1)CN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

STK543209
Synonyms: (2E)-N-{[4-(2-methoxyphenyl)piperazin-1-yl]carbonothioyl}-3-phenylprop-2-enamide
Smiles: COc1ccccc1N1CCN(CC1)C(=S)NC(=O)/C=C/c1ccccc1

STK543210
Synonyms: (2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(o1)c1ccc(cc1)Br)/c1nc2c(n1C)cccc2

STK543211
Synonyms: (9E)-9-(4-chlorobenzylidene)-5-(4-chlorophenyl)-3-phenyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: Clc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccccc1)/C(=C/c1ccc(cc1)Cl)/CCC2

STK543212
Synonyms: 2-{[8,8-dimethyl-3-(3-methylphenyl)-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1cccc(c1)C

STK543213
Synonyms: ethyl{[8-ethyl-8-methyl-3-(4-methylphenyl)-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2nc3CC(C)(CC)OCc3cc2c(=O)n1c1ccc(cc1)C

STK543214
Synonyms: 8-benzyl-9-[(4-bromobenzyl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: Brc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCc1c3cccc1

STK543215
Synonyms: (6aR,6bS,9aR,10S)-10-[(4-bromophenyl)carbonyl]-2-chloro-8-(2,4-dichlorophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Clc1ccc2c(c1)N1[C@H](C=C2)[C@@H]2[C@H]([C@H]1C(=O)c1ccc(cc1)Br)C(=O)N(C2=O)c1ccc(cc1Cl)Cl

STK543216
Synonyms: 4-butyl-2,6-bis(4-chlorophenyl)-3,5-dimethylpiperidin-4-ol
Smiles: CCCCC1(O)C(C)C(NC(C1C)c1ccc(cc1)Cl)c1ccc(cc1)Cl

STK543217
Synonyms: 3-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-2-(phenoxymethyl)quinazolin-4(3H)-one
Smiles: CN(c1ccc(cc1)/C=N/n1c(COc2ccccc2)nc2c(c1=O)cccc2)C

STK543219
Synonyms: 2-(2-methoxy-5-{(E)-[(2-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)imino]methyl}benzyl)-1H-isoindole-1,3(2H)-dione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK543220
Synonyms: N-(4-bromophenyl)-2-[(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)sulfanyl]acetamide
Smiles: CCCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCC(=O)Nc1ccc(cc1)Br

STK543221
Synonyms: ethyl6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-(piperidin-1-ylmethyl)-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(CN2CCCCC2)n(c2c1c(CN(C)C)c(O)c(c2)Br)C

STK543222
Synonyms: 2-[3-(4-benzylpiperazin-1-yl)quinoxalin-2-yl]-2-cyano-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)C#N

STK543223
Synonyms: S-{[5-oxo-4-(2-phenylethyl)-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]methyl}(4-methoxyphenyl)carbamothioate
Smiles: COc1ccc(cc1)NC(=O)SCc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CCCC3

STK543224
Synonyms: 3-{[4-(3-methylbutoxy)benzyl]sulfanyl}-4H-1,2,4-triazol-4-amine
Smiles: CC(CCOc1ccc(cc1)CSc1nncn1N)C

STK543225
Synonyms: 2-(ethylsulfanyl)-3-(3-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK543226
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK543227
Synonyms: 2-[4-(2-chlorobenzyl)piperazin-1-yl]-N'-[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1Cl)N/N=C/C(=C/c1ccccc1)/Cl

STK543228
Synonyms: (4E)-5-(2-fluorophenyl)-4-[(4-fluorophenyl)(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)/C(=C\1/C(c2ccccc2F)N(C(=O)C1=O)c1nnc(s1)C)/O

STK543230
Synonyms: 2,5-dichloro-N-{3-[(4-methylphenyl)amino]quinoxalin-2-yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)Nc1nc2ccccc2nc1NS(=O)(=O)c1cc(Cl)ccc1Cl

STK543231
Synonyms: 7-benzyl-3-(3-methylphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCN(C3)Cc1ccccc1

STK543234
Synonyms: 2,6-bis(4-chlorophenyl)-4-(4-fluorophenyl)-3,5-dimethylpiperidin-4-ol
Smiles: Fc1ccc(cc1)C1(O)C(C)C(NC(C1C)c1ccc(cc1)Cl)c1ccc(cc1)Cl

STK543238
Synonyms: 2-{[7-benzyl-3-(3-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-bromophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCN(C3)Cc1ccccc1

STK543239
Synonyms: (3aR,6aS)-3-(3,4-dimethoxyphenyl)-5-(2-methoxy-5-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1cc(ccc1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1cc(ccc1OC)[N+](=O)[O-]

STK543240
Synonyms: N-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}carbonothioyl)pyridine-3-carboxamide
Smiles: S=C(N1CCN(CC1)C/C=C/c1ccccc1)NC(=O)c1cccnc1

STK543241
Synonyms: 2-[(4-methylbenzyl)sulfanyl]-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

STK543242
Synonyms: N-(3-fluorophenyl)-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: Fc1cccc(c1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)C)c(nn1c1ccccc1)C

STK543243
Synonyms: N-[(2-bromo-4-methylphenyl)carbamothioyl]-4-fluorobenzamide
Smiles: S=C(Nc1ccc(cc1Br)C)NC(=O)c1ccc(cc1)F

STK543244
Synonyms: N-(3-chlorophenyl)-10-methyl-11-(3-nitrophenyl)-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Clc1cccc(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccc(c1)[N+](=O)[O-])C)c1ccccc1

STK543245
Synonyms: N-(4-iodophenyl)-7-(morpholin-4-yl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Smiles: Ic1ccc(cc1)Nc1cc(N2CCOCC2)c2c(c1[N+](=O)[O-])non2

STK543246
Synonyms: diphenylmethyl(1'R,2'S,3R)-2'-[(4-fluorophenyl)carbonyl]-2-oxo-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinoline]-1'-carboxylate
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@H](C(=O)OC(c2ccccc2)c2ccccc2)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STK543247
Synonyms: diphenylmethyl(1'R,2'S,3R)-2'-[(4-chlorophenyl)carbonyl]-2-oxo-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinoline]-1'-carboxylate
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@H](C(=O)OC(c2ccccc2)c2ccccc2)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STK543250
Synonyms: (2E)-N-(1-butyl-3-cyano-1H-pyrrolo[2,3-b]quinoxalin-2-yl)-3-phenylprop-2-enamide
Smiles: CCCCn1c2nc3ccccc3nc2c(c1NC(=O)/C=C/c1ccccc1)C#N

STK543251
Synonyms: 2-[4-(2-chlorobenzyl)piperazin-1-yl]-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1c(/C=N/NC(=O)CN2CCN(CC2)Cc2ccccc2Cl)ccc(c1OC)OC

STK543252
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-bromophenyl)carbonyl]-2-(3-chlorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Clc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccc(cc2)Br)C=CC(=C1)C(=O)c1ccccc1

STK543253
Synonyms: N-(4-butoxyphenyl)-11-(4-chlorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCCCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)Cl)c(nn1c1ccccc1)C

STK543254
Synonyms: 1-[(2-methylprop-2-en-1-yl)sulfanyl]-4-(2-phenylethyl)-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CC(OC3)C(C)C

STK543255
Synonyms: N-(1,3-dioxolan-2-ylmethyl)-6,7-dimethoxy-N-methyl-2-phenylquinazolin-4-amine
Smiles: COc1cc2c(cc1OC)nc(nc2N(CC1OCCO1)C)c1ccccc1

STK543256
Synonyms: N'-[(E)-(5-bromo-2-fluorophenyl)methylidene]-2-[4-(4-methylbenzyl)piperazin-1-yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1cc(Br)ccc1F

STK543258
Synonyms: 9-(4-chlorophenyl)-2-(3-nitrophenyl)tetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Smiles: Clc1ccc(cc1)C1N2CCCN2C2C1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-]

STK543259
Synonyms: N-(4-ethylphenyl)-11-(2-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2OC)c(nn1c1ccccc1)C

STK543260
Synonyms: 3-benzyl-2-[(2,4-dimethylbenzyl)sulfanyl]-5-ethyl-5-methyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n(c(n2)SCc1ccc(cc1C)C)Cc1ccccc1

STK543261
Synonyms: N-{4-[(10-methyl-8,11-diphenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-yl)amino]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2)c(nn1c1ccccc1)C

STK543263
Synonyms: N-(4-ethylphenyl)-2-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]acetamide
Smiles: CCc1ccc(cc1)NC(=O)CN1CCN(CC1)c1nc2c(s1)cc(cc2)[N+](=O)[O-]

STK543264
Synonyms: N'-[(E)-pyridin-4-ylmethylidene]octanehydrazide
Smiles: CCCCCCCC(=O)N/N=C/c1ccncc1

STK543265
Synonyms: 2,8-dimethyl-3-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CSc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)C

STK543268
Synonyms: 4,4,7-trimethyl-8-trityl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione
Smiles: Cc1cc2NC(C)(C)c3c(c2cc1C(c1ccccc1)(c1ccccc1)c1ccccc1)c(=S)ss3

STK543269
Synonyms: methyl2-(acetylamino)-N-(6-butoxy-1,3-benzothiazol-2-yl)-3,3,3-trifluoroalaninate
Smiles: CCCCOc1ccc2c(c1)sc(n2)NC(C(F)(F)F)(C(=O)OC)NC(=O)C

STK543270
Synonyms: methyl7-(3,5-dimethylphenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Smiles: COC(=O)C1=NNC2(C1)CC(=O)N(C2=O)c1cc(C)cc(c1)C

STK543271
Synonyms: 2-amino-1-(4-fluorobenzyl)-N-hexyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)F

STK543272
Synonyms: N-(4-bromophenyl)-2-{[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)n1c(SCC(=O)Nc2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK543274
Synonyms: N-butyl-N-methyl-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
Smiles: CCCCN(c1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1)C

STK543275
Synonyms: 2-[4-(2-chlorobenzyl)piperazin-1-yl]-N'-[(E)-(3-phenoxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1Cl)N/N=C/c1cccc(c1)Oc1ccccc1

STK543276
Synonyms: 2,4-dichloro-N-{2-[2-(3-chlorophenyl)hydrazinyl]-1,1,1,3,3,3-hexafluoropropan-2-yl}benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)NC(C(F)(F)F)(C(F)(F)F)NNc1cccc(c1)Cl

STK543277
Synonyms: 11-(2-methylpropyl)-3-(prop-2-en-1-ylsulfanyl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: C=CCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)CC(C)C

STK543278
Synonyms: methyl6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: CCOc1ccc(cc1)C1C(C(=O)OC)C(=O)NC(=C1C#N)SCC(=O)N

STK543279
Synonyms: (6aR,6bS,9aR,10S)-7,9-dioxo-N,8-diphenyl-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxamide
Smiles: O=C([C@H]1N2c3ccccc3C=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)Nc1ccccc1

STK543281
Synonyms: 2-[4-(4-chlorobenzyl)piperazin-1-yl]-N'-[(3Z)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/1\C(=O)Nc2c1cccc2

STK543282
Synonyms: (3-methylphenyl)(8-methyl-2-thioxo[1,2,4]triazolo[1,5-a]pyridin-3(2H)-yl)methanone
Smiles: Cc1cccc(c1)C(=O)n1c(=S)nc2n1cccc2C

STK543283
Synonyms: 3-[(Z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(2-hydroxyethyl)piperazin-1-yl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: OCCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCCC1

STK543284
Synonyms: 3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(thiomorpholin-4-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCOCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCSCC2)/C1=O

STK543286
Synonyms: 2-(8-cyclohexyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)-N'-[(E)-furan-2-ylmethylidene]acetohydrazide
Smiles: O=C(CN1CCn2c3C1CCCc3c1c2ccc(c1)C1CCCCC1)N/N=C/c1ccco1

STK543287
Synonyms: (4-chlorophenyl)[5-(furan-2-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Smiles: Cc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)c1ccc(cc1)Cl

STK543288
Synonyms: ethyl5-bromo-3-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propanoyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCc3c(C1)cccc3)cc(cc2)Br

STK543289
Synonyms: (7E)-7-(furan-2-ylmethylidene)-2,3-diphenyl-3,3a,4,5,6,7-hexahydro-2H-indazole
Smiles: c1ccc(cc1)N1N=C2C(C1c1ccccc1)CCC/C/2=C\c1ccco1

STK543291
Synonyms: ethyl4-(4-methylphenyl)-2-{[3-(morpholin-4-yl)quinoxalin-2-yl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)C)Nc1nc2ccccc2nc1N1CCOCC1

STK543292
Synonyms: 4-[3,5-bis(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)Cl)c1ccc(cc1)Cl

STK543294
Synonyms: 5-(ethylsulfanyl)-3-{[4-(propan-2-yloxy)benzyl]sulfanyl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)OC(C)C)nn2)CCCC3

STK543295
Synonyms: N-(diphenylmethyl)-2-{[4-oxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CCCC3

STK543296
Synonyms: 1-[3-(4-bromophenyl)-5-(1-methyl-1H-indol-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1cn(c2c1cccc2)C)C(=O)C

STK543297
Synonyms: bis[5-methyl-2-(propan-2-yl)cyclohexyl]{[4-(dimethylamino)phenyl][(1-phenylethyl)amino]methyl}phosphonate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1)N(C)C)NC(c1ccccc1)C)OC1CC(C)CCC1C(C)C)C(C)C

STK543299
Synonyms: 2-[(E)-2-(2,4-dichlorophenyl)ethenyl]-3-(naphthalen-1-yl)quinazolin-4(3H)-one
Smiles: Clc1ccc(c(c1)Cl)/C=C/c1nc2ccccc2c(=O)n1c1cccc2c1cccc2

STK543300
Synonyms: (3aR,6aS)-3-(4-bromophenyl)-5-(4-chlorophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccc(cc1)Br

STK543301
Synonyms: 5-[5-(2-chloro-6,7-dimethoxyquinolin-3-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: COc1cc2cc(c(nc2cc1OC)Cl)C1CC(=NN1C(=O)CCCC(=O)O)c1ccccc1

STK543303
Synonyms: 2-[4-(4-chlorobenzyl)piperazin-1-yl]-N'-[(E)-(3,4-dichlorophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1ccc(c(c1)Cl)Cl

STK543304
Synonyms: (2E)-3-(1-benzyl-1H-indol-3-yl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(ccc1OC)C(=O)/C=C/c1cn(c2c1cccc2)Cc1ccccc1

STK543305
Synonyms: 4-bromo-N-({4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}carbamothioyl)benzamide
Smiles: COc1nc(OC)nc(c1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)Br

STK543307
Synonyms: methyl5-chloro-3-{[N-(1,3-dioxolan-2-ylmethyl)-N-methylalanyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N(CC1OCCO1)C)C)cc(cc2)Cl

STK543308
Synonyms: N-(4-methoxyphenyl)-2-{[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3

STK543309
Synonyms: 2-[4-(4-methylbenzyl)piperazin-1-yl]-N'-[(E)-(4-propoxyphenyl)methylidene]acetohydrazide
Smiles: CCCOc1ccc(cc1)/C=N/NC(=O)CN1CCN(CC1)Cc1ccc(cc1)C

STK543310
Synonyms: (3aS,6aS)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Smiles: COc1ccc(cc1)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1

STK543311
Synonyms: diphenylmethyl(6aR,6bS,9aR,10S)-8-(3-chlorophenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: Clc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)OC(c1ccccc1)c1ccccc1

STK543312
Synonyms: N-(4-bromophenyl)-2-[(4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK543314
Synonyms: 10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e]tetrazolo[1,5-c]pyrimidine
Smiles: c1ccc(cc1)c1nc2sc3c(c2c2c1CCC2)ncn1c3nnn1

STK543315
Synonyms: methyl5-bromo-3-{[(3-chlorophenyl)carbamoyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)Nc1cccc(c1)Cl)cc(cc2)Br

STK543316
Synonyms: 2-amino-N-benzyl-1-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c2nc3ccccc3nc2n(c1N)c1ccc(cc1)Oc1ccccc1)NCc1ccccc1

STK543317
Synonyms: 2-amino-4-[3-methoxy-4-(pentyloxy)phenyl]-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: CCCCCOc1ccc(cc1OC)C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C#N

STK543319
Synonyms: ethyl4,5-dimethyl-2-[(3-{[(2-methylphenyl)sulfonyl]amino}quinoxalin-2-yl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccccc2C)sc(c1C)C

STK543321
Synonyms: 2-[(6-{[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]-1-(9H-fluoren-2-yl)ethanone
Smiles: O=C(c1ccc2c(c1)Cc1c2cccc1)CSc1nc2c(s1)cc(cc2)Nc1nc(nc(n1)N1CCCCC1)N1CCCCC1

STK543322
Synonyms: (6aR,6bS,9aR,10S)-8-(4-acetylphenyl)-10-[(4-chlorophenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1c1ccccc1C=C2)c1ccc(cc1)C(=O)C

STK543324
Synonyms: 8-chloro-3-(3,4-dimethoxybenzyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc(ccc1OC)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl

STK543325
Synonyms: N-(diphenylmethyl)-2-{[4-oxo-3-(2-phenylethyl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

STK543326
Synonyms: methyl3-{[2-(4-benzylpiperazin-1-yl)propanoyl]amino}-5-chloro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)Cc1ccccc1)C)cc(cc2)Cl

STK543328
Synonyms: (1'R,2'S,3R)-N-(4-chlorophenyl)-2'-[(4-fluorophenyl)carbonyl]-2-oxo-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinoline]-1'-carboxamide
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@H](C(=O)Nc2ccc(cc2)Cl)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STK543329
Synonyms: 9-(4-bromophenyl)-7-(4-methoxyphenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazoline
Smiles: COc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Br)c1c(CC2)cccc1

STK543330
Synonyms: 2-[(5-ethyl-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide
Smiles: CCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCC(=O)NC(CCc1ccccc1)C

STK543331
Synonyms: 2-amino-N-cyclopropyl-1-(2-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccccc1Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)NC1CC1

STK543332
Synonyms: N-benzyl-2-{[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3)NCc1ccccc1

STK543333
Synonyms: N-(2,4-dichlorophenyl)-2-{[7,7-dimethyl-4-(3-methylphenyl)-5-oxo-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)(C)C

STK543334
Synonyms: (6aR,6bS,9aR,10S)-N-(4-chlorophenyl)-8-(2,4-dimethylphenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(cc1C)C)C=Cc1c2cccc1

STK543335
Synonyms: 3-amino-N-(5-chloro-2-methylphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: Clc1ccc(c(c1)NC(=O)c1sc2c(c1N)cc1c(n2)CC(CC1=O)(C)C)C

STK543336
Synonyms: N-(4-chlorophenyl)-1-(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: Cc1ccc(cc1)c1c(C(=S)Nc2ccc(cc2)Cl)n2c3c1CCCCn3c(c2)c1ccccc1

STK543337
Synonyms: ethyl2-({(2E)-3-[4-(acetylamino)phenyl]-2-cyanoprop-2-enoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C(=C/c2ccc(cc2)NC(=O)C)/C#N)sc2c1CCCC2

STK543338
Synonyms: N-(3,4-dimethoxyphenyl)-10-methyl-8,11-diphenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1cc(ccc1OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2)c(nn1c1ccccc1)C

STK543339
Synonyms: 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N'-[(Z)-(2,4-dichlorophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C\c1ccc(cc1Cl)Cl

STK543340
Synonyms: 9'-bromo-2'-(5-bromothiophen-2-yl)-4-phenyl-1',10b'-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: Brc1ccc2c(c1)C1CC(=NN1C1(O2)CCC(CC1)c1ccccc1)c1ccc(s1)Br

STK543341
Synonyms: N-butyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: CCCCNc1ncnc2c1c1CC(C)(C)OCc1s2

STK543342
Synonyms: 2-amino-N-(4-ethoxyphenyl)-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)OC

STK543343
Synonyms: (6aR,6bS,9aR,10S)-10-[(4-chlorophenyl)carbonyl]-8-(2-fluorophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccccc1F)C=Cc1c2cccc1

STK543344
Synonyms: 11-(4-bromophenyl)-2-ethyl-3-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COCCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)Br

STK543345
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3,6,6-trimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2sc3c(c2c(=O)n1C)CC(OC3)(C)C

STK543346
Synonyms: (1'R,2'S,3R)-N-(4-chlorophenyl)-2'-(furan-2-ylcarbonyl)-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)c1ccco1)C(=O)Nc1c2cccc1

STK543347
Synonyms: 2-[4-(6-bromo-4-phenylquinolin-2-yl)phenoxy]-N'-[(E)-(2-chloro-7-ethoxyquinolin-3-yl)methylidene]acetohydrazide
Smiles: CCOc1ccc2c(c1)nc(c(c2)/C=N/NC(=O)COc1ccc(cc1)c1nc2ccc(cc2c(c1)c1ccccc1)Br)Cl

STK543348
Synonyms: 8,8-dimethyl-3-(methylsulfanyl)-11-(morpholin-4-yl)-7,10-dihydro-8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nnc2n1cnc1c2sc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK543350
Synonyms: 2-(benzylsulfanyl)-6-iodo-3-(2-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccccc1n1c(SCc2ccccc2)nc2c(c1=O)cc(cc2)I

STK543351
Synonyms: N-pentyl-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
Smiles: CCCCCNc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK543352
Synonyms: 2-(1,3-benzoxazol-2-ylsulfanyl)-N'-[(E)-(2-chloro-5-nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nc2c(o1)cccc2)N/N=C/c1cc(ccc1Cl)[N+](=O)[O-]

STK543354
Synonyms: 3-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-2-(thiomorpholin-4-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCSCC2)/C(=O)N1Cc1ccccc1

STK543355
Synonyms: 2'-(1,3-benzodioxol-5-yl)-9'-bromo-4-phenyl-1',10b'-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: Brc1ccc2c(c1)C1CC(=NN1C1(O2)CCC(CC1)c1ccccc1)c1ccc2c(c1)OCO2

STK543356
Synonyms: 3-(2-methylphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]quinazolin-4(3H)-one
Smiles: CC(=C)CSc1nc2ccccc2c(=O)n1c1ccccc1C

STK543358
Synonyms: (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: O=C1N(c2ccc3c(c2)OCO3)C(=O)[C@@H]2[C@H]1C(=NO2)c1ccc(cc1)[N+](=O)[O-]

STK543359
Synonyms: 2-ethyl-11-(furan-2-ylmethyl)-3-(2-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCc1nc2n(Cc3ccco3)c3c(c2c(=O)n1CCc1ccccc1)nc1c(n3)cccc1

STK543361
Synonyms: 4-(3,3-dimethylpiperidin-1-yl)-6,7-dimethoxy-2-phenylquinazoline
Smiles: COc1cc2nc(nc(c2cc1OC)N1CCCC(C1)(C)C)c1ccccc1

STK543364
Synonyms: 2-[(6,6-dimethyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-methyl-N-phenylacetamide
Smiles: O=C(N(c1ccccc1)C)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(SC3)(C)C

STK543365
Synonyms: 2-{[6,6-dimethyl-3-(4-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-phenylbutan-2-yl)acetamide
Smiles: CC(NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C)CCc1ccccc1

STK543367
Synonyms: 2-cyano-N-(3-methoxypropyl)-2-[3-(piperidin-1-yl)quinoxalin-2-yl]acetamide
Smiles: COCCCNC(=O)C(c1nc2ccccc2nc1N1CCCCC1)C#N

STK543368
Synonyms: 9'-bromo-2'-(3,4-dimethoxyphenyl)-4-phenyl-1',10b'-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: COc1cc(ccc1OC)C1=NN2C(C1)c1cc(Br)ccc1OC12CCC(CC1)c1ccccc1

STK543369
Synonyms: 2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(2-phenylethyl)acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCCCCC1)C(=O)NCCc1ccccc1

STK543370
Synonyms: 2-[4-(4-chlorobenzyl)piperazin-1-yl]-N'-{(E)-[4-(diethylamino)phenyl]methylidene}acetohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)CN1CCN(CC1)Cc1ccc(cc1)Cl)CC

STK543371
Synonyms: 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N'-[(E)-furan-2-ylmethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1ccco1

STK543372
Synonyms: 3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-(thiomorpholin-4-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCSCC2)/C1=O)C

STK543374
Synonyms: 2-(benzylsulfanyl)-3-(furan-2-ylmethyl)-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: O=C1N(Cc2ccco2)C(SCc2ccccc2)NC2=C1C1(CCCCC1)Cc1c2cccc1

STK543376
Synonyms: 3-[(2-methylprop-2-en-1-yl)sulfanyl]-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CC(=C)CSc1nnc2n1cnc1c2sc2c1c1CCCc1c(n2)c1ccccc1

STK543377
Synonyms: (1'R,2'S,3R)-2'-[(4-fluorophenyl)carbonyl]-2-oxo-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinoline]-1'-carboxamide
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@H](C(=O)N)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STK543378
Synonyms: methyl3-{[(4-benzylpiperidin-1-yl)acetyl]amino}-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)Cc1ccccc1)cc(c(c2)OC)OC

STK543380
Synonyms: ethyl4-[({[4-oxo-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nc2sc3c(c2c(=O)n1CC=C)CCC3

STK543381
Synonyms: 3-(4-chlorophenyl)-1,6,6-triphenyl-3-azabicyclo[3.1.0]hexane-2,4-dione
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)(C2(c1ccccc1)c1ccccc1)c1ccccc1

STK543382
Synonyms: 10-methyl-N-(3-methylphenyl)-11-(3-nitrophenyl)-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1cccc(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccc(c1)[N+](=O)[O-])C)c1ccccc1

STK543383
Synonyms: 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N'-[(E)-phenylmethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1ccccc1

STK543384
Synonyms: [5-(1-benzyl-1H-indol-3-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl](phenyl)methanone
Smiles: O=C(N1N=C(CC1c1cn(c2c1cccc2)Cc1ccccc1)c1ccccc1)c1ccccc1

STK543386
Synonyms: 17-(3-chloro-4-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: O=C1N(c2ccc(c(c2)Cl)[N+](=O)[O-])C(=O)C2C1C1c3ccccc3C2c2c1cccc2

STK543387
Synonyms: 5-(furan-2-yl)-2,2-dimethyl-8-(pentylsulfanyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK543388
Synonyms: N-phenyl-4-{2-[(phenylsulfonyl)amino]-1,2-dihydroacenaphthylen-1-yl}piperazine-1-carbothioamide
Smiles: S=C(N1CCN(CC1)C1c2cccc3c2c(C1NS(=O)(=O)c1ccccc1)ccc3)Nc1ccccc1

STK543389
Synonyms: 9'-bromo-2'-(2,4-dichlorophenyl)-2,2-dimethyl-1',2,3,5,6,10b'-hexahydrospiro[pyran-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: Clc1ccc(c(c1)Cl)C1=NN2C(C1)c1cc(Br)ccc1OC12CCOC(C1)(C)C

STK543390
Synonyms: 2,2'-[(11-tert-butyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine-3,7-diyl)disulfanediyl]bis[N-(4-methoxyphenyl)acetamide]
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc2n1c1sc3c(c1c1n2c(SCC(=O)Nc2ccc(cc2)OC)nn1)CCC(C3)C(C)(C)C

STK543391
Synonyms: 8-methoxy-2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3OC

STK543392
Synonyms: 4-(2-methoxyphenyl)-5-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1n1c(=S)[nH]nc1c1cccnc1

STK543394
Synonyms: 3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(butan-2-ylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCC(Nc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)C

STK543395
Synonyms: 5-ethyl-5-methyl-3-phenyl-2-(propan-2-ylsulfanyl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n(c(n2)SC(C)C)c1ccccc1

STK543396
Synonyms: 7-(3,4-dimethoxyphenyl)-2-oxo-3,5,6,7-tetrahydro-2H-thiopyrano[2,3-d][1,3]thiazole-6-carbonitrile
Smiles: N#CC1CSc2c(C1c1ccc(c(c1)OC)OC)sc(=O)[nH]2

STK543397
Synonyms: N-(diphenylmethyl)-2-[(10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nnc2n1cnc1c2sc2c1c1CCCc1c(n2)c1ccccc1

STK543399
Synonyms: N-benzyl-2-{[7-benzyl-3-(3-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: O=C(CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCN(C3)Cc1ccccc1)NCc1ccccc1

STK543401
Synonyms: N-(1,3-benzodioxol-5-yl)-11-(2-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Fc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc2c(c1)OCO2)c1ccccc1

STK543403
Synonyms: 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N'-[(1Z)-1-(3,4-dichlorophenyl)ethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C(\c1ccc(c(c1)Cl)Cl)/C

STK543404
Synonyms: 2-[(2-{[(2,4-dichlorophenyl)carbonyl]amino}-1,1,1,3,3,3-hexafluoropropan-2-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1sc2c(c1C(=O)N)CCCC2

STK543405
Synonyms: ethyl2-(propanoylamino)-4,5-dihydronaphtho[1,2-b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CC)sc2c1CCc1c2cccc1

STK543406
Synonyms: 2-(4-benzylpiperidin-1-yl)-1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)propan-1-one
Smiles: CC(C(=O)N1CCc2c(C1)c1ccccc1[nH]2)N1CCC(CC1)Cc1ccccc1

STK543407
Synonyms: 3-benzyl-5-ethyl-2-(ethylsulfanyl)-5-methyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CCSc1nc2c3ccccc3CC(c2c(=O)n1Cc1ccccc1)(C)CC

STK543408
Synonyms: methyl4-{6-[(2,3-dimethylphenyl)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(c1C)C)nc1c2cccc1

STK543409
Synonyms: (8S,8aR,11aS,11bS)-10-(4-acetylphenyl)-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]2[C@@H]2N1N=Cc1c2cccc1)c1ccc(cc1)C(=O)C)c1ccccc1

STK543410
Synonyms: (8S,8aR,11aS)-N-(4-chlorophenyl)-10-(2-fluorophenyl)-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)c1ccccc1F)cccc3

STK543412
Synonyms: 2-{3-[(3aS,6aS)-5-(1,3-benzodioxol-5-yl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazol-3-yl]-3-oxopropyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(c2ccc3c(c2)OCO3)C(=O)[C@@H]2[C@H]1C(=NN2)C(=O)CCN1C(=O)c2c(C1=O)cccc2

STK543413
Synonyms: (9E)-3-(4-bromophenyl)-9-[4-(difluoromethoxy)-3-methoxybenzylidene]-5-[4-(difluoromethoxy)-3-methoxyphenyl]-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: COc1cc(ccc1OC(F)F)/C=C/1\CCCC2=C1N=c1scc(n1C2c1ccc(c(c1)OC)OC(F)F)c1ccc(cc1)Br

STK543414
Synonyms: 11-benzyl-3-cyclohexyl-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1nc2n(Cc3ccccc3)c3c(c2c(=O)n1C1CCCCC1)nc1c(n3)cccc1

STK543415
Synonyms: (6aR,6bS,9aR,10S)-7,9-dioxo-8-[3-(trifluoromethyl)phenyl]-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxamide
Smiles: O=C1N(c2cccc(c2)C(F)(F)F)C(=O)[C@@H]2[C@H]1[C@H]1C=Cc3c(N1[C@@H]2C(=O)N)cccc3

STK543416
Synonyms: 2-{4-[(1,3-benzodioxol-5-ylcarbonyl)carbamothioyl]piperazin-1-yl}-8-ethyl-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1nc(nc2)N1CCN(CC1)C(=S)NC(=O)c1ccc2c(c1)OCO2

STK543417
Synonyms: methyl3,3,3-trifluoro-N-(4-methyl-1,3-benzothiazol-2-yl)-2-(propanoylamino)alaninate
Smiles: COC(=O)C(C(F)(F)F)(Nc1sc2c(n1)c(C)ccc2)NC(=O)CC