FULL DB

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

STK551741
Synonyms: (5E)-5-[(1-acetyl-1H-indol-3-yl)methylidene]-1-(2-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCc1ccccc1N1C(=O)NC(=O)/C(=C\c2cn(c3c2cccc3)C(=O)C)/C1=O

STK551742
Synonyms: 3-(2-chlorophenyl)-2-{(E)-2-[4-(dimethylamino)phenyl]ethenyl}-6-iodoquinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)N(C)C)c1ccccc1Cl

STK551743
Synonyms: 2-{[1-(2-chlorobenzyl)-1H-benzimidazol-2-yl]sulfanyl}-N'-[(E)-1H-indol-3-ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nc2c(n1Cc1ccccc1Cl)cccc2)N/N=C/c1c[nH]c2c1cccc2

STK551744
Synonyms: 2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N'-[(E)-(3-methylthiophen-2-yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccccc1)N/N=C/c1sccc1C

STK551745
Synonyms: 2-(methylsulfanyl)-N-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Smiles: CSc1nc(NCCc2ccccc2)c2c(n1)sc1c2CCCC1

STK551746
Synonyms: ethyl3-{[3-(4-benzylpiperazin-1-yl)propanoyl]amino}-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)Cc1ccccc1)cc(c(c2)OC)OC

STK551747
Synonyms: 2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Smiles: C=CCn1c(SCC(=O)NCCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551748
Synonyms: 5-(4-butoxyphenyl)-3-(3-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCCCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1cccc(c1)[N+](=O)[O-]

STK551750
Synonyms: N-benzyl-2-imino-1,10-dimethyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: O=C(c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1C)NCc1ccccc1

STK551751
Synonyms: butyl4-{[(1E)-8-hydroxy-4-oxo-3-(pyrrolidin-1-yl)naphthalen-1(4H)-ylidene]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)/N=C/1\C=C(N2CCCC2)C(=O)c2c1c(O)ccc2

STK551752
Synonyms: 2-{(E)-2-[4-(dimethylamino)phenyl]ethenyl}-6-iodo-3-(naphthalen-1-yl)quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)N(C)C)c1cccc2c1cccc2

STK551753
Synonyms: N-(3,4-difluorophenyl)-2-(2-fluorophenyl)quinazolin-4-amine
Smiles: Fc1cc(ccc1F)Nc1nc(nc2c1cccc2)c1ccccc1F

STK551754
Synonyms: 2-(4-chlorophenyl)-3-{5-[2-(propan-2-yloxy)phenoxy]pentyl}quinazolin-4(3H)-one
Smiles: CC(Oc1ccccc1OCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl)C

STK551757
Synonyms: methyl4-{6-[(2-ethoxyphenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzoate
Smiles: CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(=O)OC)c(nn1c1ccccc1)C

STK551758
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(1E)-1-[4-(2-methylpropyl)phenyl]ethylidene}-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CC(Cc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)/C)C

STK551760
Synonyms: 2-{[5-(methylsulfanyl)-10-(propan-2-yl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1cccc4c1cccc4)nn2)CC(OC3)C(C)C

STK551761
Synonyms: 3-[6-(4-chloro-3-methylphenoxy)hexyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1ccc(c(c1)C)Cl

STK551763
Synonyms: 2,2-diphenyl-N-(tetrahydrofuran-2-ylmethyl)cyclopropanecarboxamide
Smiles: O=C(C1CC1(c1ccccc1)c1ccccc1)NCC1CCCO1

STK551766
Synonyms: 1-(furan-2-yl)-N-(thiophen-2-ylmethyl)but-3-en-1-amine
Smiles: C=CCC(c1ccco1)NCc1cccs1

STK551768
Synonyms: 2-(4-ethylphenyl)-9-(4-fluorophenyl)tetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)N1N(C2c2ccc(cc2)F)CCC1

STK551769
Synonyms: 1-amino-N-(4-methylphenyl)-5-(morpholin-4-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK551770
Synonyms: 5-(2,4-dimethylphenyl)-3-(3-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1cccc(c1)[N+](=O)[O-]

STK551771
Synonyms: 5H-dibenzo[b,f]azepine-5-carbonylchloride
Smiles: ClC(=O)N1c2ccccc2C=Cc2c1cccc2

STK551773
Synonyms: 1-[3-phenyl-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Smiles: CC(=O)N1N=C(CC1c1cccs1)c1ccccc1

STK551775
Synonyms: ethyl5-bromo-3-{[3-(4-phenylpiperazin-1-yl)propanoyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1)cc(cc2)Br

STK551776
Synonyms: 1-phenyl-1H-tetrazol-5-yl(1E)-N-(4-methylphenyl)-2-oxopropanehydrazonothioate
Smiles: Cc1ccc(cc1)N/N=C(\C(=O)C)/Sc1nnnn1c1ccccc1

STK551779
Synonyms: 2-[(2-methylbenzyl)sulfanyl]-3-(2-methylprop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CC(=C)Cn1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551781
Synonyms: 2-[(4-amino-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc(N)c2c(n1)sc1c2CC(OC1)(C)C

STK551783
Synonyms: N~2~,N~2~-diethyl-N~4~-(furan-2-ylmethyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: CCN(c1nc(NCc2ccco2)c(c(n1)N)[N+](=O)[O-])CC

STK551784
Synonyms: 4-bromo-2-({[2-(naphthalen-2-yl)imidazo[1,2-a]pyridin-3-yl]imino}methyl)phenol
Smiles: Brc1ccc(c(c1)/C=N/c1c(nc2n1cccc2)c1ccc2c(c1)cccc2)O

STK551785
Synonyms: 3-(2-hydroxy-3,4-dimethylphenyl)-3-phenyl-N-(2-phenylethyl)propanamide
Smiles: O=C(CC(c1ccc(c(c1O)C)C)c1ccccc1)NCCc1ccccc1

STK551786
Synonyms: 3,3'-[benzene-1,3-diylbis(oxy)]bis[1-(piperidin-1-yl)propan-2-ol]
Smiles: OC(CN1CCCCC1)COc1cccc(c1)OCC(CN1CCCCC1)O

STK551787
Synonyms: 11-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-(2-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccc(cc1)CCn1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1

STK551788
Synonyms: 1-(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)C/C=C/c1ccccc1)c(n2Cc1ccccc1)C

STK551790
Synonyms: diethyl2,2'-(2,2',4,4'-tetraoxo-5,5'-bi-1,3-thiazolidine-3,3'-diyl)diacetate
Smiles: CCOC(=O)CN1C(=O)SC(C1=O)C1SC(=O)N(C1=O)CC(=O)OCC

STK551791
Synonyms: N-[3-(dibenzylamino)-2-hydroxypropyl]-N-(4-methylphenyl)-4-nitrobenzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)C)CN(Cc1ccccc1)Cc1ccccc1

STK551792
Synonyms: 4-amino-N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-1,2,5-oxadiazole-3-carbohydrazonamide
Smiles: COc1ccc(cc1/C=N/N=C(/c1nonc1N)\N)OC

STK551793
Synonyms: N-carbamoyl-4-({(E)-2-cyano-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)NC(=O)N)/c1scc(n1)c1ccc(cc1)CC

STK551795
Synonyms: 2-[(2-methylbenzyl)sulfanyl]-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCn1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551796
Synonyms: N-(12-cyanoindolizino[2,3-b]quinoxalin-3-yl)-4-fluorobenzamide
Smiles: N#Cc1c2ccc(cn2c2c1nc1ccccc1n2)NC(=O)c1ccc(cc1)F

STK551797
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551798
Synonyms: 14-(3,4-diethoxyphenyl)-2,3-diethoxy-13-(morpholin-4-ylmethyl)-5,6-dihydrobenzo[6,7]indolo[2,1-a]isoquinolin-12-ol
Smiles: CCOc1cc(ccc1OCC)c1c2c(CN3CCOCC3)c(O)c3c(c2n2c1c1cc(OCC)c(cc1CC2)OCC)cccc3

STK551799
Synonyms: methyl(2Z)-[2-(3-chlorophenyl)hydrazinylidene][(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanoate
Smiles: COC(=O)/C(=N/Nc1cccc(c1)Cl)/Sc1nnc(n1c1ccccc1)c1ccccc1

STK551800
Synonyms: 11-(1,3-benzodioxol-5-ylmethyl)-2-ethyl-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: C=CCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc2c(c1)OCO2

STK551801
Synonyms: ethyl3-{[3-(4-benzylpiperidin-1-yl)propanoyl]amino}-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)Cc1ccccc1)cc(c(c2)OC)OC

STK551802
Synonyms: N-[2-(dimethylamino)ethyl]-9-fluoro-7-hydroxy-3-methyl-5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-6-carboxamide
Smiles: CN(CCNC(=O)c1c(O)c2cc(F)cc3c2n(c1=O)C(C)CC3)C

STK551803
Synonyms: ethyl4-{[11-(4-ethylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)CC)C)c1ccccc1

STK551804
Synonyms: 2-[(3-fluorobenzyl)sulfanyl]-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: Fc1cccc(c1)CSc1nc(N)c2c(n1)sc1c2CC(OC1)(C)C

STK551805
Synonyms: (2Z)-N-(3-chlorophenyl)-2-cyano-2-[(5Z)-5-(2-methoxybenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: COc1ccccc1/C=c/1\s/c(=C(\C(=O)Nc2cccc(c2)Cl)/C#N)/n(c1=O)c1ccccc1

STK551806
Synonyms: 5-ethyl-3-(hexylsulfanyl)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCCCCCSc1nnc2n1c(CC)nc1c2c2CC(C)(C)OCc2s1

STK551807
Synonyms: 3-(2-methylpropyl)-2-(prop-2-yn-1-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: C#CCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(C)C)CCCC3

STK551808
Synonyms: 2-amino-1-(3-methylbutyl)-N-(tetrahydrofuran-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CC(CCn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCC1CCCO1)C

STK551809
Synonyms: 2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}-N,N-dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3)CCC

STK551811
Synonyms: 2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK551812
Synonyms: (8R,8aS,11aR)-10-(2,5-dimethoxyphenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1cc(OC)ccc1OC)cccc3

STK551814
Synonyms: 3-{5-[(3-chlorobenzyl)sulfanyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CCOc1ccc(cc1)n1c(SCc2cccc(c2)Cl)nnc1c1cccnc1

STK551815
Synonyms: (6aS,6bR,9aS,10R)-10-[(4-chlorophenyl)carbonyl]-8-[2-(trifluoromethyl)phenyl]-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)c1ccccc1C(F)(F)F)C=Cc1c2cccc1

STK551816
Synonyms: ethyl2-({[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc(N)c3c(n2)sc2c3CCCC2)sc(c1C)C

STK551817
Synonyms: 2-(pyridin-2-yl)-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine
Smiles: FC(c1cccc(c1)Nc1nc(nc2c1cccc2)c1ccccn1)(F)F

STK551818
Synonyms: (5E)-1-(3-chloro-4-methylphenyl)-5-(4-methoxy-3-nitrobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)C

STK551819
Synonyms: N-[(1E)-3-{[2-(1H-indol-3-yl)ethyl]amino}-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide
Smiles: COc1ccc(cc1)/C=C(\C(=O)NCCc1c[nH]c2c1cccc2)/NC(=O)c1cccs1

STK551821
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK551825
Synonyms: 2-amino-N-(3-methoxypropyl)-1-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1

STK551826
Synonyms: N-(3-chloro-4-methoxyphenyl)-11-(3-chlorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Cl)c(nn1c1ccccc1)C

STK551827
Synonyms: (1'S,2'S,3R,3a'R)-2'-[(2,5-dimethoxyphenyl)carbonyl]-1'-(2,2-dimethylpropanoyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C)OC

STK551828
Synonyms: ethyl(2Z)-3,4-dihydroquinolin-1(2H)-yl[2-(3-nitrophenyl)hydrazinylidene]ethanoate
Smiles: CCOC(=O)/C(=N/Nc1cccc(c1)[N+](=O)[O-])/N1CCCc2c1cccc2

STK551829
Synonyms: 5-(decylsulfanyl)-3-octyl-1H-1,2,4-triazole
Smiles: CCCCCCCCCCSc1[nH]nc(n1)CCCCCCCC

STK551830
Synonyms: 2-(4-butoxyphenyl)-6,6-dimethyl-4-[(3-methylbutyl)sulfanyl]-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCCC(C)C)c2c(n1)sc1c2CC(OC1)(C)C

STK551832
Synonyms: 3-(4-methoxyphenyl)-2-[(3-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccc(cc1)n1c(SCc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK551834
Synonyms: 5-ethyl-3-(methylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCc1nc2sc3c(c2c2n1c(SC)nn2)CCC3

STK551837
Synonyms: 1-[3,3-bis(4-chlorophenyl)-3'-phenyl-3H,3'H-spiro[2-benzothiophene-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone
Smiles: Clc1ccc(cc1)C1(SC2(c3c1cccc3)SC(=NN2c1ccccc1)C(=O)C)c1ccc(cc1)Cl

STK551839
Synonyms: 7-({2-[benzyl(methyl)amino]ethyl}amino)-3-methyl-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: CN(Cc1ccccc1)CCNc1cc2oc3cc(C)ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1

STK551840
Synonyms: (8S,8aR,11aS,11bS)-8-(2,2-dimethylpropanoyl)-10-(2-fluorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Fc1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)C(C)(C)C)C=Cc2c1cccc2

STK551842
Synonyms: (2E)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)F

STK551843
Synonyms: methyl4-[5-(4-methylphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)C)c1ccccc1

STK551844
Synonyms: 5,7-diiodoquinolin-8-ylpiperidine-1-carboxylate
Smiles: O=C(N1CCCCC1)Oc1c(I)cc(c2c1nccc2)I

STK551845
Synonyms: N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}pyridine-3-carboxamide(non-preferredname)
Smiles: O=C(CNC(=O)c1cccnc1)N/N=C(/Cc1ccccc1)\C

STK551846
Synonyms: 2-(ethylsulfanyl)-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCn1c(SCC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551847
Synonyms: N-{[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinyl]carbonothioyl}-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC(=S)NNC(=O)c1ccc2c(c1)OCO2

STK551848
Synonyms: 4-(4-methylphenyl)-1-[(naphthalen-2-ylmethyl)sulfanyl]-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Cc1ccc(cc1)n1c(=O)c2c3CCCc3sc2n2c1nnc2SCc1ccc2c(c1)cccc2

STK551849
Synonyms: 2-(4-chlorophenyl)-3-[6-(2-ethoxyphenoxy)hexyl]quinazolin-4(3H)-one
Smiles: CCOc1ccccc1OCCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK551851
Synonyms: 11-(4-ethylphenyl)-10-methyl-N-(3-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cccc(c1)C)nc1c2cccc1

STK551852
Synonyms: 4-[4-(3-chlorophenyl)piperazin-1-yl]-2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxyquinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCN(CC1)c1cccc(c1)Cl)c1ccc(c(c1)OC)OC

STK551853
Synonyms: (5Z)-1-[4-(butan-2-yl)phenyl]-5-{[1-(4-methylbenzyl)-1H-indol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccc(cc2)C)/C1=O)C

STK551854
Synonyms: N~4~-(2-fluorophenyl)-5-nitro-N~2~-(tetrahydrofuran-2-ylmethyl)pyrimidine-2,4,6-triamine
Smiles: [O-][N+](=O)c1c(N)nc(nc1Nc1ccccc1F)NCC1CCCO1

STK551855
Synonyms: 3-(furan-2-ylmethyl)-2-[(3-methylbutyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CC(CCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3)C

STK551856
Synonyms: 4-butyl-7-[(4-fluorobenzyl)sulfanyl]-2,3,5a,10b-tetrahydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3SCc1ccc(cc1)F

STK551858
Synonyms: 2-[(4-methylbenzyl)sulfanyl]-3-(2-methylprop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CC(=C)Cn1c(SCc2ccc(cc2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551859
Synonyms: 2-[(2-phenylethyl)sulfanyl]-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCn1c(SCCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551860
Synonyms: 5-[(4-butoxy-3-nitrobenzyl)sulfanyl]-2-methyl-4-nitro-1H-imidazole
Smiles: CCCCOc1ccc(cc1[N+](=O)[O-])CSc1[nH]c(nc1[N+](=O)[O-])C

STK551861
Synonyms: N,N-diethyl-N'-[11-(2-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-yl]benzene-1,4-diamine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)N(CC)CC)c1ccccc1

STK551862
Synonyms: 12-[(2-chlorobenzyl)oxy]-14-(3,4-diethoxyphenyl)-2,3-diethoxy-5,6-dihydrobenzo[6,7]indolo[2,1-a]isoquinoline
Smiles: CCOc1cc(ccc1OCC)c1c2cc(OCc3ccccc3Cl)c3c(c2n2c1c1cc(OCC)c(cc1CC2)OCC)cccc3

STK551863
Synonyms: N-(4-methylphenyl)-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Smiles: CC(=C)Cn1c(SCC(=O)Nc2ccc(cc2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551864
Synonyms: ethyl5-methoxy-3-({3-[4-(2-methoxyphenyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1OC)cc(cc2)OC

STK551865
Synonyms: N-(4-butylphenyl)-11-(4-ethylphenyl)-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)CC)C)c1ccccc1

STK551866
Synonyms: N-[2-hydroxy-3-(piperidin-1-yl)propyl]-2-nitro-N-phenylbenzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1)CN1CCCCC1

STK551867
Synonyms: 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}-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)(C)C

STK551868
Synonyms: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
Smiles: OCCN1CCN(CC1)CC(=O)c1c(C)[nH]c2c1cc(OC)cc2

STK551871
Synonyms: 3-(3-methylphenyl)-2-(prop-2-yn-1-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: C#CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK551872
Synonyms: 4-[(2-chlorobenzyl)sulfanyl]-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: CSc1nc(SCc2ccccc2Cl)c2c(n1)sc1c2CCCC1

STK551873
Synonyms: 2-{[6,6-dimethyl-3-(4-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(1-phenylpropan-2-yl)acetamide
Smiles: CC(Cc1ccccc1)NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(OC3)(C)C

STK551874
Synonyms: 3-methyl-7-{[2-(4-phenylpiperazin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: Cc1ccc2c(c1)oc1c([nH]2)c2c(c(c1)NCCN1CCN(CC1)c1ccccc1)c(=O)c1c(c2=O)cccc1

STK551875
Synonyms: 6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-5-ium-1-yl)-4-oxo-1-phenyl-1,4-dihydropyrimidine-2-thiolate
Smiles: O=c1nc([S-])n(c(c1C1OCc2c1c(O)c([nH+]c2)C)O)c1ccccc1

STK551876
Synonyms: N-[3-(dibutylamino)-2-hydroxypropyl]-N-phenylbenzenesulfonamide
Smiles: CCCCN(CC(CN(S(=O)(=O)c1ccccc1)c1ccccc1)O)CCCC

STK551878
Synonyms: (5E)-1-(3-chloro-4-methylphenyl)-5-(2-methoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccccc1/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)C

STK551880
Synonyms: 1-[3-(dimethylamino)propyl]-7,7-dimethyl-2-phenyl-1,5,7,8-tetrahydro-4H-pyrano[4,3-d]pyrimidine-4-thione
Smiles: CN(CCCn1c(nc(=S)c2c1CC(C)(C)OC2)c1ccccc1)C

STK551881
Synonyms: 4-hydroxy-N-[(5Z)-4-oxo-5-(pyridin-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: Oc1ccc(cc1)C(=O)NN1C(=S)S/C(=C\c2ccccn2)/C1=O

STK551882
Synonyms: 6-{[(2E)-3-(3,4-diethoxyphenyl)-2-{[(2-methylphenyl)carbonyl]amino}prop-2-enoyl]amino}hexanoicacid
Smiles: CCOc1cc(ccc1OCC)/C=C(\C(=O)NCCCCCC(=O)O)/NC(=O)c1ccccc1C

STK551885
Synonyms: 6-chloro-4-phenyl-2-[3-phenyl-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]quinazoline
Smiles: Clc1ccc2c(c1)c(nc(n2)N1N=C(CC1c1cccs1)c1ccccc1)c1ccccc1

STK551887
Synonyms: (2E)-3-(3,4-dimethoxyphenyl)-N-[(2-{[(1S,2S)-2-phenylcyclopropyl]carbonyl}hydrazinyl)carbonothioyl]prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)NC(=S)NNC(=O)[C@H]2C[C@@H]2c2ccccc2)ccc1OC

STK551891
Synonyms: 6-{[(2E)-3-(3,4-diethoxyphenyl)-2-{[(4-methoxyphenyl)carbonyl]amino}prop-2-enoyl]amino}hexanoicacid
Smiles: CCOc1cc(ccc1OCC)/C=C(\C(=O)NCCCCCC(=O)O)/NC(=O)c1ccc(cc1)OC

STK551892
Synonyms: (8R,8aS,11aR)-8-[(4-methoxyphenyl)carbonyl]-10-(4-methylphenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)C)cccc3

STK551893
Synonyms: 2-(pentylsulfanyl)-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCn1c(SCCCCC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551895
Synonyms: 2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N,N-dibutylacetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3)CCCC

STK551896
Synonyms: 3-butyl-2-(ethylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCCn1c(SCC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551897
Synonyms: 2-[(5-oxo-4-phenyl-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]-N-(1-phenylpropan-2-yl)acetamide
Smiles: O=C(NC(Cc1ccccc1)C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3

STK551898
Synonyms: N-(3-chloro-2-methylphenyl)-2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)Cl)nnc1c1cccnc1

STK551899
Synonyms: 3-ethyl-2-(heptylsulfanyl)-6-iodoquinazolin-4(3H)-one
Smiles: CCCCCCCSc1nc2ccc(cc2c(=O)n1CC)I

STK551900
Synonyms: (8R,8aS,11aR)-10-(4-bromophenyl)-8-(2,2-dimethylpropanoyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: Brc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=N1)C(=O)C(C)(C)C

STK551901
Synonyms: N-benzyl-2-{[8,8-dimethyl-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]pyrimidin-3-yl]sulfanyl}acetamide
Smiles: O=C(NCc1ccccc1)CSc1nnc2n1cnc1c2sc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK551903
Synonyms: 3-(3,4-dimethoxybenzyl)-8-fluoro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc(ccc1OC)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)F

STK551906
Synonyms: N'-{[(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetyl}-2-methylbenzohydrazide
Smiles: COc1c(OC)ccc2c1c(nnc2)SCC(=O)NNC(=O)c1ccccc1C

STK551908
Synonyms: 5-chloro-4-(2-chloro-10H-phenothiazin-10-yl)-N-(2,3-dimethylphenyl)-3,6-difluoropyridin-2-amine
Smiles: Clc1ccc2c(c1)N(c1c(F)c(nc(c1Cl)F)Nc1cccc(c1C)C)c1c(S2)cccc1

STK551909
Synonyms: (2E)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-{[2-(trifluoromethyl)phenyl]amino}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1C(F)(F)F)/c1scc(n1)c1ccc(cc1)OC

STK551912
Synonyms: 2-(ethoxycarbonyl)phenyl1-chloro-4-(4-chlorophenyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylate
Smiles: CCOC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C(Cl)C(CC1C(N2)c1ccc(cc1)Cl)Sc1ccccc1[N+](=O)[O-]

STK551913
Synonyms: 2-(2-{[5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: CSc1nc2sc3c(c2c2n1c(SCCN1C(=O)c4c(C1=O)cccc4)nn2)CCCC3

STK551914
Synonyms: 2-{[4-(4-bromophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-diethylacetamide
Smiles: CCN(C(=O)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1)CC

STK551915
Synonyms: 2-[(5-oxo-4-phenyl-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]-N-(2-phenylethyl)acetamide
Smiles: O=C(CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3)NCCc1ccccc1

STK551917
Synonyms: 1-(2-chloro-10H-phenothiazin-10-yl)-2-(dimethylamino)ethanone
Smiles: CN(CC(=O)N1c2ccccc2Sc2c1cc(Cl)cc2)C

STK551918
Synonyms: ethyl3-{[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)propanoyl]amino}-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCC3(CC1)OCCO3)C)cc(c(c2)OC)OC

STK551919
Synonyms: 1-[(2-chlorobenzyl)sulfanyl]-4-(4-methylphenyl)-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(s2)n2c(SCc3ccccc3Cl)nnc2n(c1=O)c1ccc(cc1)C)C

STK551925
Synonyms: 4-{6-[(4-ethylphenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzene-1,2-diol
Smiles: CCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)O)O)c(nn1c1ccccc1)C

STK551926
Synonyms: (1'R,2'R,3a'S)-2'-(4-bromophenyl)-1'-(2,2-dimethylpropanoyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Brc1ccc(cc1)[C@H]1[C@@H](N2[C@H]([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

STK551927
Synonyms: ethyl3-({3-[4-(4-fluorophenyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccc(cc1)F)cccc2

STK551928
Synonyms: 3-propyl-2-(prop-2-yn-1-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCn1c(SCC#C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551929
Synonyms: 5-(2-chlorophenyl)-3-[(2,4-dichlorobenzyl)sulfanyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1ccc(c(c1)Cl)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl

STK551931
Synonyms: 3-benzyl-2-[(2-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cc1ccccc1CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK551932
Synonyms: 3-(4-hydroxyphenyl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(cc1)O

STK551933
Synonyms: 11-(3,4-dichlorophenyl)-3-(3,5-dimethylphenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1cc(C)cc(c1)n1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)Cl)Cl

STK551934
Synonyms: ethyl4-(5-{(E)-[(7,8-dimethoxy-2,4-dioxo-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)imino]methyl}furan-2-yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(c(c1)OC)OC

STK551935
Synonyms: (2'R,3'R)-2'-(2,5-dimethoxyphenyl)-3'-(phenylcarbonyl)-2',3'-dihydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-1,3-dione
Smiles: COc1ccc(c(c1)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2)OC

STK551936
Synonyms: 1-amino-N-(furan-2-ylmethyl)-5-(morpholin-4-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)NCc1ccco1

STK551937
Synonyms: 4,6-bis(4-chlorophenyl)-2-phenylpyrimidine
Smiles: Clc1ccc(cc1)c1cc(nc(n1)c1ccccc1)c1ccc(cc1)Cl

STK551938
Synonyms: 2-(2-{[6,6-dimethyl-3-(3-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: Cc1cccc(c1)n1c(SCCN2C(=O)c3c(C2=O)cccc3)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK551939
Synonyms: 11-(4-tert-butylphenyl)-N-(2-ethoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)(C)C)c(nn1c1ccccc1)C

STK551940
Synonyms: (5Z)-5-(2-methoxybenzylidene)-3-(naphthalen-2-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccccc1/C=C/1\SC(=S)N(C1=O)c1ccc2c(c1)cccc2

STK551942
Synonyms: N-(3-methylphenyl)-2-{[4-oxo-3-(2-phenylethyl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK551943
Synonyms: 2-(4-methylphenyl)-3-[(4-nitrophenyl)sulfonyl]-1,3-thiazolidine
Smiles: Cc1ccc(cc1)C1SCCN1S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

STK551945
Synonyms: (8R,8aS,11aR)-8-[(4-methoxyphenyl)carbonyl]-10-(2-methyl-4-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-])cccc3

STK551948
Synonyms: ethyl[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]acetate
Smiles: CCCn1c(SCC(=O)OCC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551950
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-3-ethyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCn1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551952
Synonyms: 3-[4-(4-ethoxyphenyl)-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine
Smiles: CCOc1ccc(cc1)n1c(nnc1c1cccnc1)SCc1cccc(c1)C(F)(F)F

STK551953
Synonyms: (2E)-3-{[4-chloro-2-(trifluoromethyl)phenyl]amino}-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(F)(F)F)Cl)/c1scc(n1)c1ccc(cc1)OC

STK551955
Synonyms: 1-methoxypropan-2-yl2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CC(C)C)C

STK551956
Synonyms: 4-phenyl-5H-pyridazino[4,5-b]indole-1-thiol
Smiles: Sc1nnc(c2c1c1ccccc1[nH]2)c1ccccc1

STK551957
Synonyms: 3,3'-(furan-2-ylmethanediyl)bis(1,5-dioxaspiro[5.5]undecane-2,4-dione)
Smiles: O=C1OC2(CCCCC2)OC(=O)C1C(C1C(=O)OC2(OC1=O)CCCCC2)c1ccco1

STK551959
Synonyms: 3-[(2-chlorobenzyl)sulfanyl]-5-ethyl-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCc1nc2sc3c(c2c2n1c(SCc1ccccc1Cl)nn2)CC(OC3)(C)C

STK551961
Synonyms: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCc3c(C1)cc(c(c3)OC)OC)c([nH]2)C

STK551962
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[2-(benzyloxy)-3-methoxyphenyl]methylidene}-5-(morpholin-4-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1OCc1ccccc1)/C=N/NC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N

STK551963
Synonyms: N-(4-fluorophenyl)-2-[4-(propan-2-yloxy)phenyl]quinazolin-4-amine
Smiles: CC(Oc1ccc(cc1)c1nc(Nc2ccc(cc2)F)c2c(n1)cccc2)C

STK551965
Synonyms: 1-(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-2-(4-benzylpiperidin-1-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCC(CC1)Cc1ccccc1)c(n2Cc1ccccc1)C

STK551967
Synonyms: 12-hexyl-9-(hexylsulfanyl)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7(12H)-one
Smiles: CCCCCCSc1nnc2n1c(=O)c1c(n2CCCCCC)c2ccccc2CC21CCCC2

STK551968
Synonyms: 3-(4-bromophenyl)-5-[4-(propan-2-yl)phenyl]-3a,6a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(3H,5H)-tetrone
Smiles: Brc1ccc(cc1)C1OC2(C3C1C(=O)N(C3=O)c1ccc(cc1)C(C)C)C(=O)c1c(C2=O)cccc1

STK551969
Synonyms: 3-methyl-N-[2-(naphthalen-2-yl)imidazo[1,2-a]pyridin-3-yl]butanamide
Smiles: CC(CC(=O)Nc1c(nc2n1cccc2)c1ccc2c(c1)cccc2)C

STK551970
Synonyms: (5Z)-2-[(3,4-dimethylphenyl)amino]-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1cc(/C=C/2\SC(=NC2=O)Nc2ccc(c(c2)C)C)cc(c1OC)OC

STK551972
Synonyms: 2-{[10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1cccc4c1cccc4)nn2)CC(OC3)(C)C

STK551973
Synonyms: 4-(3-methylphenyl)-1-[(naphthalen-2-ylmethyl)sulfanyl]-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(s2)n2c(SCc3ccc4c(c3)cccc4)nnc2n(c1=O)c1cccc(c1)C)C

STK551976
Synonyms: N-(3,4-difluorophenyl)-2-[4-(propan-2-yloxy)phenyl]quinazolin-4-amine
Smiles: CC(Oc1ccc(cc1)c1nc(Nc2ccc(c(c2)F)F)c2c(n1)cccc2)C

STK551977
Synonyms: N-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}-4-methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK551978
Synonyms: 2-[(1,3-dioxolan-2-ylmethyl)(methyl)amino]-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN(CC1OCCO1)C)c([nH]2)C

STK551979
Synonyms: 2-({4-amino-6-[(3-methylphenyl)amino]-5-nitropyrimidin-2-yl}amino)ethanol
Smiles: OCCNc1nc(Nc2cccc(c2)C)c(c(n1)N)[N+](=O)[O-]

STK551980
Synonyms: methyl1-acetyl-7-(3-bromophenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Smiles: COC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1cccc(c1)Br)C(=O)C

STK551981
Synonyms: 11-[4-(dimethylamino)phenyl]-N-(4-ethoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)N(C)C)c(nn1c1ccccc1)C

STK551982
Synonyms: 4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]morpholine
Smiles: FC(c1nnc(s1)N1CCOCC1)(F)F

STK551984
Synonyms: N-[3-(dimethylamino)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)CC(CN(C)C)O

STK551987
Synonyms: N-[2-hydroxy-3-(pyrrolidin-1-yl)propyl]-N-(4-methylphenyl)naphthalene-2-sulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccc2c(c1)cccc2)c1ccc(cc1)C)CN1CCCC1

STK551989
Synonyms: 3-(2,5-dimethylphenyl)-11-(3,5-dimethylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1cc(C)cc(c1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)c1cc(C)ccc1C

STK551990
Synonyms: N'-[(E)-(2-hydroxy-5-nitrophenyl)methylidene]-2-oxopiperidine-3-carbohydrazide
Smiles: [O-][N+](=O)c1cc(/C=N/NC(=O)C2CCCNC2=O)c(cc1)O

STK551991
Synonyms: ethyl7-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC3(CC1)OCCO3)cc1c(c2)OCO1

STK551992
Synonyms: 1-[(2,6-dichlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-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: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(C)(C)OCc1s2)SCc1c(Cl)cccc1Cl

STK551993
Synonyms: 11-(3-chlorophenyl)-N-(4-ethylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Cl)c(nn1c1ccccc1)C

STK551994
Synonyms: 2-amino-N-(prop-2-en-1-yl)-1-(3,4,5-trimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(OC)c(c(c1)OC)OC

STK551995
Synonyms: 2-[(3-methylbenzyl)sulfanyl]-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cc1cccc(c1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

STK551996
Synonyms: (2E)-2-cyano-2-[5-(2,5-dichlorobenzyl)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(2,4-dimethylphenyl)ethanamide
Smiles: N#C/C(=C/1\SC(C(=O)N1c1ccccc1)Cc1cc(Cl)ccc1Cl)/C(=O)Nc1ccc(cc1C)C

STK551997
Synonyms: 3-(2,5-dichlorophenyl)-11-(3,4-dimethylphenyl)-2-ethyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCc1nc2n(c3ccc(c(c3)C)C)c3c(c2c(=O)n1c1cc(Cl)ccc1Cl)nc1c(n3)cccc1

STK551998
Synonyms: 6-chloro-3-[5-(2-fluorophenyl)-1-(furan-2-ylcarbonyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenylquinolin-2(1H)-one
Smiles: Clc1ccc2c(c1)c(c1ccccc1)c(c(=O)[nH]2)C1=NN(C(C1)c1ccccc1F)C(=O)c1ccco1

STK551999
Synonyms: 3-{[3-(1H-benzotriazol-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]amino}phenyl2-chlorobenzoate
Smiles: O=C1c2ccccc2C(=O)C(=C1Nc1cccc(c1)OC(=O)c1ccccc1Cl)n1nnc2c1cccc2

STK552000
Synonyms: N-(4-bromophenyl)-2-[(10-butyl-7,8,9,11a-tetrahydro-6bH-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: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncn1c3nnc1SCC(=O)Nc1ccc(cc1)Br

STK552001
Synonyms: 7,8-dimethyl-2-(thiophen-2-yl)-4-(trifluoromethyl)-3H-1,5-benzodiazepine
Smiles: Cc1cc2N=C(CC(=Nc2cc1C)c1cccs1)C(F)(F)F

STK552002
Synonyms: N-(2-methylphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552006
Synonyms: (9E)-9-(4-chlorobenzylidene)-5-(4-chlorophenyl)-3-(4-methoxyphenyl)-7-methyl-6,7,8,9-tetrahydro-5H-pyrido[4,3-d][1,3]thiazolo[3,2-a]pyrimidine
Smiles: COc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccc(cc1)Cl)CN(C/C/3=C\c1ccc(cc1)Cl)C

STK552007
Synonyms: 11-(4-fluorophenyl)-10-methyl-N,8-diphenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Fc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccccc1)c1ccccc1

STK552008
Synonyms: 2-[(E)-2-(3-methylphenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
Smiles: Cc1cccc(c1)/C=C/c1nc2ccccc2c(=O)n1c1ccc(cc1)[N+](=O)[O-]

STK552009
Synonyms: (6aR,6bS,9aR,10S)-8-(3-nitrophenyl)-N-(4-nitrophenyl)-7,9-dioxo-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)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1[C@H]1C=Cc3c(N1[C@@H]2C(=O)Nc1ccc(cc1)[N+](=O)[O-])cccc3

STK552011
Synonyms: N-[3-(dimethylamino)-2-hydroxypropyl]-N-(2-methoxy-5-nitrophenyl)benzenesulfonamide
Smiles: COc1ccc(cc1N(S(=O)(=O)c1ccccc1)CC(CN(C)C)O)[N+](=O)[O-]

STK552013
Synonyms: 4-{[(6aS,6bR,9aS,10R)-8-(4-butoxyphenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinolin-10-yl]carbonyl}phenylacetate
Smiles: CCCCOc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)c1ccc(cc1)OC(=O)C

STK552014
Synonyms: N-[3-(dimethylamino)-2-hydroxypropyl]-N-(3-methylphenyl)benzenesulfonamide
Smiles: CN(CC(CN(S(=O)(=O)c1ccccc1)c1cccc(c1)C)O)C

STK552015
Synonyms: 3-butyl-2-[(3-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCn1c(SCc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK552016
Synonyms: 10-(4-bromophenyl)pyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
Smiles: Brc1ccc(cc1)n1c2ccccc2cc2c1nc(=O)[nH]c2=O

STK552017
Synonyms: 2-(2-bromo-4,5-diphenyl-1H-imidazol-1-yl)-1-phenylethanone
Smiles: O=C(c1ccccc1)Cn1c(Br)nc(c1c1ccccc1)c1ccccc1

STK552018
Synonyms: (5Z)-1-(3-chloro-4-methylphenyl)-5-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\c1cn(c2c1cccc2)CCOc1ccccc1)c1ccc(c(c1)Cl)C

STK552020
Synonyms: 3,3'-[propane-2,2-diylbis(benzene-4,1-diyloxy)]bis[1-(dimethylamino)propan-2-ol]
Smiles: OC(CN(C)C)COc1ccc(cc1)C(c1ccc(cc1)OCC(CN(C)C)O)(C)C

STK552024
Synonyms: 2-(3,4-dimethoxyphenyl)-7-ethoxy-4-[4-(4-fluorophenyl)piperazin-1-yl]-6-methoxyquinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCN(CC1)c1ccc(cc1)F)c1ccc(c(c1)OC)OC

STK552026
Synonyms: 2-amino-N-(2,5-dimethylphenyl)-1-hexyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1cc(C)ccc1C

STK552027
Synonyms: N,N-diethyl-N'-[11-(2-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-yl]benzene-1,4-diamine
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1F)C)c1ccccc1)CC

STK552028
Synonyms: 9-(3,4-dichlorophenyl)-3-methyl-1-phenyl-1H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidine-5,7(6H,9H)-dione
Smiles: O=c1[nH]c(=O)c2c(n1)n(c1ccc(c(c1)Cl)Cl)c1c(c2)c(nn1c1ccccc1)C

STK552029
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(3-chlorobenzyl)oxy]-3-ethoxyphenyl}methylidene]-5-(phenoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)ccc1OCc1cccc(c1)Cl

STK552030
Synonyms: N-(naphthalen-1-yl)-2-[(11-propyl-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)sulfanyl]acetamide
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnc1SCC(=O)Nc1cccc2c1cccc2

STK552031
Synonyms: 2-{4-[butyl(ethyl)amino]quinazolin-2-yl}phenol
Smiles: CCCCN(c1nc(nc2c1cccc2)c1ccccc1O)CC

STK552032
Synonyms: 2-chloro-6-methoxy-3-[1-(methylsulfonyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-5-yl]quinoline
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)C1CC(=NN1S(=O)(=O)C)c1cccs1

STK552035
Synonyms: N'-[(E)-1H-indol-3-ylmethylidene]-2-[(1-methyl-1H-benzimidazol-2-yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nc2c(n1C)cccc2)N/N=C/c1c[nH]c2c1cccc2

STK552036
Synonyms: 7'-(4-methoxyphenyl)-2,2-dimethyl-6',16'-bis(phenylcarbonyl)-6',7',8b',8c',16',16a'-hexahydro-8a'H-spiro[1,3-dioxane-5,8'-pyrrolo[1,2-a']pyrrolo[1,2-a:3,4-c']diquinoline]-4,6-dione
Smiles: COc1ccc(cc1)C1C(C(=O)c2ccccc2)N2C(C31C(=O)OC(OC3=O)(C)C)C1C3C=Cc4c(N3C(C1c1c2cccc1)C(=O)c1ccccc1)cccc4

STK552037
Synonyms: (4aS,4bR,7aS,8R)-6-(4-bromophenyl)-8-[(3-nitrophenyl)carbonyl]-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: Brc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK552038
Synonyms: (4aS,4bR,7aS,8R)-8-[(3-nitrophenyl)carbonyl]-6-phenyl-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: O=C1N(c2ccccc2)C(=O)[C@@H]2[C@H]1[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK552040
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-3-(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)n1c(SCc2ccc(cc2)Cl)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552041
Synonyms: [(1R,2S,3R)-2-(4-bromophenyl)-1-nitro-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazin-3-yl](4-methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@H]([C@H]1c1ccc(cc1)Br)[N+](=O)[O-])cccc3

STK552042
Synonyms: 3-(2-hydroxyphenyl)-2-[(E)-2-(4-methylphenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Cc1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1c1ccccc1O

STK552044
Synonyms: 1-cyclohexyl-3-hydroxy-4-[4-(prop-2-en-1-yloxy)phenyl]-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: C=CCOc1ccc(cc1)C1SCC(=O)Nc2c1c(O)nn2C1CCCCC1

STK552045
Synonyms: 4-(benzyloxy)-N-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: Fc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)OCc1ccccc1

STK552046
Synonyms: 1-amino-N-(3-methoxyphenyl)-5-(morpholin-4-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: COc1cccc(c1)NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK552047
Synonyms: N-(4-ethoxyphenyl)-11-(3-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)OC)c(nn1c1ccccc1)C

STK552049
Synonyms: (9E)-9-(4-chlorobenzylidene)-3,5-bis(4-chlorophenyl)-7-methyl-6,7,8,9-tetrahydro-5H-pyrido[4,3-d][1,3]thiazolo[3,2-a]pyrimidine
Smiles: Clc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)/C(=C/c1ccc(cc1)Cl)/CN(C2)C

STK552050
Synonyms: 2-[(3-ethyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N,N-diphenylpropanamide
Smiles: CCn1c(SC(C(=O)N(c2ccccc2)c2ccccc2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552051
Synonyms: propan-2-yl2-amino-1-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C(F)(F)F)C

STK552055
Synonyms: (2'R,3'R)-N-(4-chlorophenyl)-2'-(4-methoxyphenyl)-1,3-dioxo-1,2',3,3'-tetrahydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-3'-carboxamide
Smiles: COc1ccc(cc1)[C@H]1[C@H](C(=O)Nc2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

STK552057
Synonyms: ethyl5-methoxy-3-{[3-(4-phenylpiperazin-1-yl)propanoyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1)cc(cc2)OC

STK552058
Synonyms: 10-[3-(trifluoromethyl)phenyl]pyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
Smiles: O=c1[nH]c(=O)c2c(n1)n(c1cccc(c1)C(F)(F)F)c1c(c2)cccc1

STK552059
Synonyms: ethyl4-{6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2ccc(cc2)[N+](=O)[O-])nc2c(c1=O)cc(cc2)I

STK552060
Synonyms: 1-(2-hydroxyethyl)-2-imino-3-[(4-methylphenyl)sulfonyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Smiles: OCCn1c2nc3ccccn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccc(cc1)C

STK552063
Synonyms: phenyl(2-thioxo[1,2,4]triazolo[5,1-b][1,3]benzothiazol-1(2H)-yl)methanone
Smiles: S=c1nc2n(n1C(=O)c1ccccc1)c1c(s2)cccc1

STK552065
Synonyms: 2-{[5-(ethylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: CCSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)C)nn2)CCCC3

STK552066
Synonyms: N~2~-(butan-2-yl)-N~4~-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: CCC(Nc1nc(Nc2ccc(cc2)OC)c(c(n1)N)[N+](=O)[O-])C

STK552068
Synonyms: 2-amino-1-(4-chloro-3-nitrophenyl)-N-hexyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)[N+](=O)[O-])Cl

STK552069
Synonyms: N-[(2-methoxydibenzo[b,d]furan-3-yl)carbamothioyl]-4-propoxybenzamide
Smiles: CCCOc1ccc(cc1)C(=O)NC(=S)Nc1cc2oc3c(c2cc1OC)cccc3

STK552071
Synonyms: 2-(4-chlorophenyl)-3-{2-[2-(naphthalen-2-yloxy)ethoxy]ethyl}quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1ccc2c(c1)cccc2

STK552072
Synonyms: (8R,8aS,11aR)-10-(2,4-dimethylphenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3

STK552073
Synonyms: (6aR,6bS,9aR,10S)-8-(2-chlorophenyl)-N-(4-nitrophenyl)-7,9-dioxo-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]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccccc1Cl)C=Cc1c2cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK552077
Synonyms: 2-{[5-(2-chlorophenyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(4-phenylbutan-2-yl)acetamide
Smiles: CC(NC(=O)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl)CCc1ccccc1

STK552078
Synonyms: 7-chloro-4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC(Cc1nc2sc3c(c2c2c1CCC2)ncnc3Cl)C

STK552079
Synonyms: 10-methyl-N,8-diphenyl-11-(thiophen-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1nn(c2c1C(c1cccs1)n1c(=N2)c(Nc2ccccc2)nc2c1cccc2)c1ccccc1

STK552080
Synonyms: (5Z)-5-({1-[3-(3,4-dimethylphenoxy)propyl]-1H-indol-3-yl}methylidene)-1-(4-fluorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2ccc(c(c2)C)C)/C1=O

STK552081
Synonyms: 2-(3,4-dimethoxyphenyl)-4-(3,5-dimethylpiperidin-1-yl)-7-ethoxy-6-methoxyquinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CC(C)CC(C1)C)c1ccc(c(c1)OC)OC

STK552082
Synonyms: (2E)-N-(3-chlorophenyl)-2-cyano-2-[(5E)-5-(2,4-dichlorobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: N#C/C(=c/1\s/c(=C/c2ccc(cc2Cl)Cl)/c(=O)n1c1ccccc1)/C(=O)Nc1cccc(c1)Cl

STK552083
Synonyms: 5-ethyl-5-methyl-2-(methylsulfanyl)-3-(2-phenylethyl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CSc1nc2c3ccccc3CC(c2c(=O)n1CCc1ccccc1)(C)CC

STK552084
Synonyms: (5Z)-5-{[1-(4-chlorobenzyl)-1H-indol-3-yl]methylidene}-1-(3-chloro-4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccc(cc2)Cl)/C1=O

STK552085
Synonyms: dimethyl2-[(3-{[(4-chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1Nc1nc2ccccc2nc1NS(=O)(=O)c1ccc(cc1)Cl)C(=O)OC

STK552087
Synonyms: 3-{2-[2-(2-bromophenoxy)ethoxy]ethyl}-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1ccccc1Br

STK552088
Synonyms: N'-(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)-N,N-dimethylpropane-1,3-diamine
Smiles: CN(CCCNc1ncnc2c1[nH]c1c2cc(cc1)F)C

STK552091
Synonyms: (2'R,3'R)-3'-(2,2-dimethylpropanoyl)-2'-(4-methoxyphenyl)-2',3'-dihydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-1,3-dione
Smiles: COc1ccc(cc1)[C@H]1[C@@H](N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2)C(=O)C(C)(C)C

STK552094
Synonyms: N-benzyl-1-(2-hydroxyethyl)-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: OCCn1c(=N)c(cc2c1nc1ccccn1c2=O)C(=O)NCc1ccccc1

STK552098
Synonyms: N-(1,3-benzodioxol-5-yl)-10-methyl-8-phenyl-11-(3,4,5-trimethoxyphenyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1c(OC)cc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc2c(c1)OCO2)c1ccccc1

STK552099
Synonyms: 3-(2-chlorophenyl)-6-iodo-2-{(E)-2-[4-(propan-2-yl)phenyl]ethenyl}quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)C(C)C)c1ccccc1Cl

STK552100
Synonyms: 3-benzyl-2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-5-ethyl-5-methyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n(c(n2)SCC(=O)c1ccc(cc1)Br)Cc1ccccc1

STK552101
Synonyms: 2-(4-chlorophenyl)-3-[6-(4-methoxyphenoxy)hexyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)OCCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK552102
Synonyms: (5Z)-5-({1-[3-(4-tert-butylphenoxy)propyl]-1H-indol-3-yl}methylidene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\c1cn(c2c1cccc2)CCCOc1ccc(cc1)C(C)(C)C)Cc1ccco1

STK552103
Synonyms: N-carbamoyl-4-({(E)-2-cyano-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)NC(=O)N)/c1scc(n1)c1cccc(c1)OC

STK552104
Synonyms: 2-imino-10-methyl-N-(4-methylbenzyl)-5-oxo-1-(prop-2-en-1-yl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: C=CCn1c(=N)c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCc1ccc(cc1)C

STK552108
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-3-(prop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: C=CCn1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552109
Synonyms: 4-[(E)-{2-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]phenylbenzenesulfonate
Smiles: O=C1N=C(S/C/1=C/c1ccc(cc1)OS(=O)(=O)c1ccccc1)N1CCN(CC1)c1ccc(c(c1)Cl)C

STK552110
Synonyms: (2Z)-[2-(4-methoxyphenyl)hydrazinylidene][4-(3-methoxyphenyl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: COc1ccc(cc1)N/N=C(\c1scc(n1)c1cccc(c1)OC)/C#N

STK552111
Synonyms: 6-iodo-3-(2-methyl-5-nitrophenyl)-2-[(E)-2-(3-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1cccc(c1)[N+](=O)[O-])c1cc(ccc1C)[N+](=O)[O-]

STK552112
Synonyms: (4bR,7aS,8R)-6-(2-fluorophenyl)-8-[(4-methoxyphenyl)carbonyl]-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1F

STK552113
Synonyms: 4-(6-{[4-(diethylamino)phenyl]amino}-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)benzene-1,2-diol
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)O)O)c(nn1c1ccccc1)C)CC

STK552114
Synonyms: 2-{[2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]sulfanyl}-1-phenylethanone
Smiles: CSc1nc(SCC(=O)c2ccccc2)c2c(n1)sc1c2CCCC1

STK552115
Synonyms: 2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3,4,5-trimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(cc1OC)CCNC(=O)c1c2nc3ccccc3nc2n(c1N)c1cc(OC)c(c(c1)OC)OC

STK552118
Synonyms: 2-(ethylsulfanyl)-6-iodo-3-(2-methylprop-2-en-1-yl)quinazolin-4(3H)-one
Smiles: CCSc1nc2ccc(cc2c(=O)n1CC(=C)C)I

STK552120
Synonyms: 3-(2-chlorophenyl)-2-(4-chlorophenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one
Smiles: Clc1ccc(cc1)N1C(=O)N2N(C1c1ccccc1Cl)CCC2

STK552121
Synonyms: N-cyclopentyl-1-(furan-2-ylmethyl)-2-imino-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: O=C(c1cc2c(n(c1=N)Cc1ccco1)nc1n(c2=O)cccc1C)NC1CCCC1

STK552123
Synonyms: N-(4-ethoxyphenyl)-11-(4-ethylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)CC)C)c1ccccc1

STK552124
Synonyms: prop-2-en-1-yl2-amino-1-(2-ethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccccc1CC

STK552125
Synonyms: 1-amino-N-methyl-5-(morpholin-4-yl)-N-phenyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)N(c1ccccc1)C

STK552127
Synonyms: 2-[(2-methylprop-2-en-1-yl)sulfanyl]-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CC(=C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK552128
Synonyms: 2-(4-chlorophenyl)-3-[5-(2,3,6-trimethylphenoxy)pentyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1c(C)ccc(c1C)C

STK552129
Synonyms: N-(1,3-benzodioxol-5-yl)-11-(3,4-dimethoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc2c(c1)OCO2)c1ccccc1

STK552130
Synonyms: 2-(4-ethylphenyl)-9-(4-methylphenyl)tetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)N1N(C2c2ccc(cc2)C)CCC1

STK552132
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-4-[(4-chlorobenzyl)oxy]-5-methoxyphenyl}methylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2cccc(c2)[N+](=O)[O-])c2nonc2N)cc(c1OCc1ccc(cc1)Cl)Br

STK552134
Synonyms: (1'S,2'S,3R,3a'R)-2'-[(3,4-dimethoxyphenyl)carbonyl]-1'-(2,2-dimethylpropanoyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc(cc1OC)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

STK552135
Synonyms: 2-[(2,6-dichlorobenzyl)sulfanyl]-6,6-dimethyl-3-(4-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Cc1ccc(cc1)n1c(SCc2c(Cl)cccc2Cl)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552136
Synonyms: N-(3-chloro-4-methoxyphenyl)-11-(4-ethylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(c(c1)Cl)OC)nc1c2cccc1

STK552137
Synonyms: methyl5-(4-methylphenyl)-4,6-dioxo-1-(3-oxobutyl)-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)C)CCC(=O)C

STK552138
Synonyms: 5-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidine
Smiles: CSc1nc2nnnn2c2c1c1CCCCc1s2

STK552139
Synonyms: 4,4'-sulfanediylbis(6-bromo-2-methylquinoline)
Smiles: Cc1cc(Sc2cc(C)nc3c2cc(Br)cc3)c2c(n1)ccc(c2)Br

STK552144
Synonyms: 2-{[10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)F)nn2)CC(OC3)(C)C

STK552149
Synonyms: 2-[(4-methylbenzyl)sulfanyl]-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK552150
Synonyms: 4-[5-(4-bromophenyl)-3'-(4-methoxyphenyl)-1'-phenyl-4,5-dihydro-1H,1'H-3,4'-bipyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccc(cc1)c1nn(cc1C1=NN(C(C1)c1ccc(cc1)Br)C(=O)CCC(=O)O)c1ccccc1

STK552151
Synonyms: N-benzyl-2-{[4-oxo-3-(2-phenylethyl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3)NCc1ccccc1

STK552152
Synonyms: 3-[(4-bromobenzyl)sulfanyl]-5-(methylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)Br)nn2)CCC3

STK552153
Synonyms: 1-(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-2-[4-(4-fluorophenyl)piperazin-1-yl]ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1ccc(cc1)F)c(n2Cc1ccccc1)C

STK552154
Synonyms: 3-(furan-2-yl)-1-(methylsulfonyl)-5-phenyl-4,5-dihydro-1H-pyrazole
Smiles: CS(=O)(=O)N1N=C(CC1c1ccccc1)c1ccco1

STK552155
Synonyms: N~2~-[3-(dimethylamino)propyl]-N~4~-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: COc1ccc(cc1)Nc1nc(NCCCN(C)C)nc(c1[N+](=O)[O-])N

STK552156
Synonyms: (2Z)-[2-(4-ethylphenyl)hydrazinylidene][4-(3-methoxyphenyl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)CC)/c1scc(n1)c1cccc(c1)OC

STK552157
Synonyms: 11-(4-tert-butylphenyl)-10-methyl-8-phenyl-N-[3-(trifluoromethyl)phenyl]-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1nn(c2c1C(c1ccc(cc1)C(C)(C)C)n1c(=N2)c(Nc2cccc(c2)C(F)(F)F)nc2c1cccc2)c1ccccc1

STK552158
Synonyms: (1'R,2'R,3a'S)-1'-(2,2-dimethylpropanoyl)-2'-(4-nitrophenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: [O-][N+](=O)c1ccc(cc1)[C@H]1[C@@H](N2[C@H]([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

STK552161
Synonyms: 2-[(4-amino-6-propyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-1-(4-chlorophenyl)ethanone
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCC(=O)c1ccc(cc1)Cl

STK552162
Synonyms: methyl1-acetyl-7-(4-methoxyphenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Smiles: COc1ccc(cc1)N1C(=O)CC2(C1=O)CC(=NN2C(=O)C)C(=O)OC

STK552164
Synonyms: N-(3-methoxyphenyl)-2-{[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)OC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552165
Synonyms: 3-(4-bromophenyl)-7-(4-methylphenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: Cc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1ccc(cc1)Br

STK552167
Synonyms: N-[2-hydroxy-3-(piperidin-1-yl)propyl]-N-(4-nitrophenyl)benzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccccc1)c1ccc(cc1)[N+](=O)[O-])CN1CCCCC1

STK552168
Synonyms: methyl5-(4-bromophenyl)-1-(2-methylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1C

STK552169
Synonyms: 4-(4-benzylpiperazin-1-yl)-2-(3,4-dimethoxyphenyl)-7-ethoxy-6-methoxyquinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCN(CC1)Cc1ccccc1)c1ccc(c(c1)OC)OC

STK552170
Synonyms: N-(4-chlorophenyl)-4-[4-(morpholin-4-yl)-3-nitrophenyl]phthalazin-1-amine
Smiles: Clc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1

STK552171
Synonyms: (2Z)-2-{(5E)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene}-N-(3-chlorophenyl)-2-cyanoethanamide
Smiles: N#C/C(=c\1/s/c(=C/c2cn(c3c2cccc3)Cc2ccccc2)/c(=O)n1c1ccccc1)/C(=O)Nc1cccc(c1)Cl

STK552172
Synonyms: (2R,3R)-3-[(4-methoxyphenyl)carbonyl]-2-phenyl-2,3-dihydropyrrolo[2,1-a]phthalazine-1,1(10bH)-dicarbonitrile
Smiles: N#CC1(C#N)[C@@H](c2ccccc2)[C@@H](N2C1c1ccccc1C=N2)C(=O)c1ccc(cc1)OC

STK552174
Synonyms: 3-benzyl-2-[(4-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3

STK552175
Synonyms: 3-[6-(2-bromo-4,6-dimethylphenoxy)hexyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1c(C)cc(cc1Br)C

STK552176
Synonyms: 2-(2-fluorophenyl)-4-{(2Z)-2-[1-(4-fluorophenyl)ethylidene]hydrazinyl}quinazoline
Smiles: Fc1ccc(cc1)/C(=N\Nc1nc(nc2c1cccc2)c1ccccc1F)/C

STK552177
Synonyms: 2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK552178
Synonyms: N-(3,5-dimethylphenyl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1cc(cc(c1)C)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccco2)c(nn1c1ccccc1)C

STK552179
Synonyms: 4-{6-[(3-chloro-4-methylphenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}-2-ethoxyphenol
Smiles: CCOc1cc(ccc1O)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)C)c1ccccc1

STK552180
Synonyms: (5Z)-1-(3-chloro-4-methoxyphenyl)-5-{[1-(4-methylbenzyl)-1H-indol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccc(cc2)C)/C1=O

STK552181
Synonyms: 4-(benzyloxy)-N-[(5Z)-5-(1H-indol-3-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: O=C(c1ccc(cc1)OCc1ccccc1)NN1C(=S)S/C(=C\c2c[nH]c3c2cccc3)/C1=O

STK552182
Synonyms: 4-fluoro-N-{[2-(pyridin-3-yl)piperidin-1-yl]carbonothioyl}benzamide
Smiles: Fc1ccc(cc1)C(=O)NC(=S)N1CCCCC1c1cccnc1

STK552183
Synonyms: N-(2-fluorophenyl)-2-[4-(propan-2-yloxy)phenyl]quinazolin-4-amine
Smiles: CC(Oc1ccc(cc1)c1nc(Nc2ccccc2F)c2c(n1)cccc2)C

STK552184
Synonyms: 7-(4-methoxyphenyl)-1,3-dimethyl-8-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1)c1cn2c(n1CC13CC4CC(C3)CC(C1)C4)nc1c2c(=O)n(C)c(=O)n1C

STK552185
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(2,4-dichlorophenyl)ethylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(c(c1)Cl)/C(=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)/C

STK552186
Synonyms: ethyl3-{[3-(2,6-dimethylmorpholin-4-yl)propanoyl]amino}-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CC(C)OC(C1)C)cc(cc2)OC

STK552187
Synonyms: (4Z)-4-(3-bromo-4-nitrobenzylidene)-2-phenyl-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(c(c1)Br)[N+](=O)[O-])c1ccccc1

STK552188
Synonyms: 3-ethyl-2-[(3-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCn1c(SCc2cccc(c2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552189
Synonyms: N-(2-chlorophenyl)-7-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Smiles: CC1CCN(CC1)c1cc(Nc2ccccc2Cl)c(c2c1non2)[N+](=O)[O-]

STK552190
Synonyms: 2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: C=CCn1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552191
Synonyms: (6aS,6bR,9aS,10R)-N-(4-nitrophenyl)-7,9-dioxo-8-phenyl-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]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1)C=Cc1c2cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK552192
Synonyms: ethyl4-{6-iodo-2-[(E)-2-(4-methoxyphenyl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2ccc(cc2)OC)nc2c(c1=O)cc(cc2)I

STK552193
Synonyms: 3-(4-chlorophenyl)-2-[(Z)-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)n1c(/C=C\2/c3ccccc3N(C2=O)C)nc2c(c1=O)cccc2

STK552194
Synonyms: 2-amino-1-(2,4-dimethoxyphenyl)-N-hexyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1OC)OC

STK552195
Synonyms: 2-[(3-methylbenzyl)sulfanyl]-3-(2-methylprop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: Cc1cccc(c1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3

STK552196
Synonyms: 3-[2-(4-ethylphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazol-1-yl]propan-1-ol
Smiles: OCCCn1c(cn2c1nc(c2c1ccccc1)c1ccccc1)c1ccc(cc1)CC

STK552198
Synonyms: N-benzyl-2-(4-benzylpiperazin-1-yl)quinazolin-4-amine
Smiles: c1ccc(cc1)CNc1nc(nc2c1cccc2)N1CCN(CC1)Cc1ccccc1

STK552199
Synonyms: (2E)-3-{[2-(difluoromethoxy)phenyl]amino}-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(F)F)/c1scc(n1)c1ccc(cc1)CC

STK552200
Synonyms: 2-amino-N-[2-(cyclohex-1-en-1-yl)ethyl]-1-hexyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCC1=CCCCC1

STK552202
Synonyms: N-(4-{[7-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}phenyl)acetamide
Smiles: CC1CCN(CC1)c1cc(Nc2ccc(cc2)NC(=O)C)c(c2c1non2)[N+](=O)[O-]

STK552203
Synonyms: 2-methyl-4-{4-[(4-methylphenyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one
Smiles: Cc1ccc(cc1)Nc1ccc(cc1[N+](=O)[O-])c1nn(C)c(=O)c2c1cccc2

STK552204
Synonyms: (5Z)-5-({1-[3-(2-chlorophenoxy)propyl]-1H-indol-3-yl}methylidene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2ccccc2Cl)/C1=O

STK552206
Synonyms: 1-[(4-tert-butylbenzyl)oxy]-3-(naphthalen-2-yl)quinoxalin-2(1H)-one4-oxide
Smiles: O=c1n(OCc2ccc(cc2)C(C)(C)C)c2ccccc2[n+](c1c1ccc2c(c1)cccc2)[O-]

STK552207
Synonyms: 2-[(8,8-dimethyl-5-phenyl-7,10-dihydro-8H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nnc2n1c(nc1c2COC(C1)(C)C)c1ccccc1

STK552208
Synonyms: 2-amino-1-(2,5-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(c(c1)n1c2nc3ccccc3nc2c(c1N)C(=O)NCCc1ccc(c(c1)OC)OC)OC

STK552210
Synonyms: 8-bromo-4-(3,4-dihydroisoquinolin-2(1H)-yl)-5H-pyrimido[5,4-b]indole
Smiles: Brc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCc2c(C1)cccc2

STK552211
Synonyms: (6aS,6bR,9aS,10R)-8-(4-acetylphenyl)-N-(4-nitrophenyl)-7,9-dioxo-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]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)C(=O)C)C=Cc1c2cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK552212
Synonyms: (2E)-3-{[2-(difluoromethoxy)phenyl]amino}-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(F)F)/c1scc(n1)c1ccc(cc1)F

STK552213
Synonyms: (6aR,6bS,9aR,10S)-N-(4-nitrophenyl)-7,9-dioxo-8-[2-(trifluoromethyl)phenyl]-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxamide
Smiles: O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccccc1C(F)(F)F)C=Cc1c2cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK552215
Synonyms: (8R,8aS,11aR)-10-(3-bromophenyl)-8-[(4-chlorophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)Br)cccc3

STK552216
Synonyms: (2E)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-(furan-2-yl)prop-2-enamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)/C=C/c1ccco1

STK552217
Synonyms: N-(3-methylphenyl)-4-[4-(morpholin-4-yl)-3-nitrophenyl]phthalazin-1-amine
Smiles: Cc1cccc(c1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1

STK552218
Synonyms: ethyl4-(3-hexyl-4-oxo-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl)benzoate
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)C(=O)OCC

STK552220
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperidin-1-yl)methyl]-N'-[(1E)-1-(3-nitrophenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1cccc(c1)[N+](=O)[O-])\C

STK552221
Synonyms: 2-methoxyethyl2-amino-1-(4-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C

STK552222
Synonyms: 1-(4-methylphenyl)-1H-tetrazol-5-yl(1E)-N-(3-chloro-2-methylphenyl)-2-oxopropanehydrazonothioate
Smiles: Cc1ccc(cc1)n1nnnc1S/C(=N/Nc1cccc(c1C)Cl)/C(=O)C

STK552223
Synonyms: N-[4-(acetylamino)phenyl]-2-[(3-ethyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552224
Synonyms: (2Z)-2-[(5E)-5-(4-chlorobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(3,4-dichlorophenyl)ethanamide
Smiles: N#C/C(=c\1/s/c(=C/c2ccc(cc2)Cl)/c(=O)n1c1ccccc1)/C(=O)Nc1ccc(c(c1)Cl)Cl

STK552226
Synonyms: 2-{[6-iodo-3-(3-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)SCC(=O)N(c1ccccc1)c1ccccc1)c1cccc(c1)C

STK552228
Synonyms: (2Z)-[2-(4-fluorophenyl)hydrazinylidene][4-(3-methoxyphenyl)-1,3-thiazol-2-yl]ethanenitrile
Smiles: COc1cccc(c1)c1csc(n1)/C(=N\Nc1ccc(cc1)F)/C#N

STK552229
Synonyms: 11-(2-methoxyphenyl)-10-methyl-N-(3-methylphenyl)-8-(pyridin-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)C)c1ccccn1

STK552230
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)O

STK552231
Synonyms: 1-amino-N-(diphenylmethyl)-5-(morpholin-4-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)NC(c1ccccc1)c1ccccc1

STK552232
Synonyms: 3-[(2,4-dichlorobenzyl)sulfanyl]-5-(methylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1Cl)Cl)nn2)CCC3

STK552233
Synonyms: (4E)-4-{[4-(dimethylamino)phenyl]imino}-5-hydroxy-2-(thiomorpholin-4-yl)naphthalen-1(4H)-one
Smiles: CN(c1ccc(cc1)/N=C/1\C=C(N2CCSCC2)C(=O)c2c1c(O)ccc2)C

STK552234
Synonyms: 10-butyl-7,8,9,11a-tetrahydro-6bH-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncn1c3nnc1

STK552237
Synonyms: 12-hexyl-9-(hexylsulfanyl)-6,6-dimethyl-6,12-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one
Smiles: CCCCCCSc1nnc2n1c(=O)c1c(n2CCCCCC)c2ccccc2CC1(C)C

STK552241
Synonyms: 12-butyl-9-(butylsulfanyl)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7(12H)-one
Smiles: CCCCn1c2c3ccccc3CC3(c2c(=O)n2c1nnc2SCCCC)CCCC3

STK552242
Synonyms: ethyl[(5-ethyl-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nnc2n1c(CC)nc1c2c2CC(C)(C)OCc2s1

STK552243
Synonyms: 2,2-dichloro-1-phenyl-N-(propan-2-yl)cyclopropanecarboxamide
Smiles: CC(NC(=O)C1(CC1(Cl)Cl)c1ccccc1)C

STK552244
Synonyms: 4-butyl-7-[(2-chlorobenzyl)sulfanyl]-2,3,5a,10b-tetrahydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3SCc1ccccc1Cl

STK552245
Synonyms: (5Z)-1-(3-chloro-4-methylphenyl)-5-({1-[3-(2-methylphenoxy)propyl]-1H-indol-3-yl}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\c1cn(c2c1cccc2)CCCOc1ccccc1C)c1ccc(c(c1)Cl)C

STK552246
Synonyms: ethyl1-(2-chlorophenyl)-5-(2-methoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccccc1OC)c1ccccc1Cl

STK552247
Synonyms: 1-[(3,4-dimethoxybenzyl)oxy]-3-phenylquinoxalin-2(1H)-one4-oxide
Smiles: COc1cc(ccc1OC)COn1c2ccccc2[n+](c(c1=O)c1ccccc1)[O-]

STK552250
Synonyms: N-(4-chlorophenyl)-2-[(5-hydrazinyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Smiles: NNc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)Cl)nn2)CCCC3

STK552252
Synonyms: N-(4-methylphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552253
Synonyms: 6-iodo-3-(naphthalen-2-yl)-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)[N+](=O)[O-])c1ccc2c(c1)cccc2

STK552254
Synonyms: 2-{[5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(1-phenylpropan-2-yl)acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)NC(Cc1ccccc1)C)nn2)CCCC3

STK552255
Synonyms: ethyl5-bromo-3-ethyl-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1CC)cc(cc2)Br

STK552257
Synonyms: N~4~-(4-chlorophenyl)-N~2~-(furan-2-ylmethyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: Clc1ccc(cc1)Nc1nc(NCc2ccco2)nc(c1[N+](=O)[O-])N

STK552258
Synonyms: prop-2-en-1-yl1-(3-acetylphenyl)-2-amino-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C(=O)C

STK552259
Synonyms: 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-(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)n1c(SCC(=O)c2ccc(cc2)F)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552261
Synonyms: 4-{[(6aS,6bR,9aS,10R)-8-(4-chlorophenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinolin-10-yl]carbonyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)Cl)C=Cc1c2cccc1

STK552262
Synonyms: 2-amino-1-(4-butylphenyl)-N-(2,5-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1cc(C)ccc1C

STK552263
Synonyms: 8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: CCOc1ccc(cc1)N1C(=O)C2C(C1=O)C1C(=C3CCCCC3)C2C=C1

STK552265
Synonyms: 11-(2-methoxybenzyl)-3-(2-methoxyphenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccccc1Cn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)c1ccccc1OC

STK552266
Synonyms: 9-(furan-2-ylmethyl)-5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8(9H)-one
Smiles: O=c1n(cnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)Cc1ccco1

STK552267
Synonyms: 2-[(E)-2-(1-benzyl-1H-indol-3-yl)ethenyl]-3-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)n1c(/C=C/c2cn(c3c2cccc3)Cc2ccccc2)nc2c(c1=O)cccc2

STK552269
Synonyms: N-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-5-nitropyrimidine-4,6-diamine
Smiles: COc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCN(CC1)C

STK552270
Synonyms: N-(2,5-dimethylphenyl)-N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)N(c1cc(C)ccc1C)Cc1cc2ccc(cc2nc1O)C

STK552271
Synonyms: (5E)-5-[4-(dimethylamino)benzylidene]-1-(2,4-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)NC(=O)/C(=C\c2ccc(cc2)N(C)C)/C1=O

STK552272
Synonyms: ethyl3-[(E)-(4-carbamoylpiperidin-1-yl)diazenyl]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCC(CC1)C(=O)N)cccc2

STK552273
Synonyms: (5E)-1-(2,5-dimethylphenyl)-5-(1H-indol-3-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\c2c[nH]c3c2cccc3)/C1=O)C

STK552274
Synonyms: 4-[(6aR,6bS,9aR,10S)-10-[(4-nitrophenyl)carbamoyl]-7,9-dioxo-6b,7,9a,10-tetrahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinolin-8(9H)-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK552276
Synonyms: ethyl3-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-5-phenoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1CCN1C(=O)c3c(C1=O)cccc3)cc(cc2)Oc1ccccc1

STK552277
Synonyms: 6-chloro-3-methyl-10-(4-methylphenyl)pyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
Smiles: Cc1ccc(cc1)n1c2cccc(c2cc2c1nc(=O)n(c2=O)C)Cl

STK552278
Synonyms: (9E)-3-(4-chlorophenyl)-9-(4-methoxybenzylidene)-5-(4-methoxyphenyl)-7-methyl-6,7,8,9-tetrahydro-5H-pyrido[4,3-d][1,3]thiazolo[3,2-a]pyrimidine
Smiles: COc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)/C(=C/c1ccc(cc1)OC)/CN(C2)C

STK552280
Synonyms: N-(4-{[7-(dimethylamino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1cc(N(C)C)c2c(c1[N+](=O)[O-])non2

STK552281
Synonyms: (4aS,4bR,7aS,8R)-6-(2-fluorophenyl)-8-[(3-nitrophenyl)carbonyl]-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: O=C1[C@H]2[C@@H](C(=O)N1c1ccccc1F)[C@H]1N([C@H]2C(=O)c2cccc(c2)[N+](=O)[O-])N=CC=C1

STK552282
Synonyms: N~4~-benzyl-N~2~-(butan-2-yl)-5-nitropyrimidine-2,4,6-triamine
Smiles: CCC(Nc1nc(NCc2ccccc2)c(c(n1)N)[N+](=O)[O-])C

STK552283
Synonyms: (4bR,7aS,8R)-8-[(4-methoxyphenyl)carbonyl]-6-(4-methylphenyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)C

STK552284
Synonyms: 6-ethyl-2-[(3-fluorobenzyl)sulfanyl]-6-methyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: CCC1(C)OCc2c(C1)c1c(N)nc(nc1s2)SCc1cccc(c1)F

STK552288
Synonyms: (2'R,3'R)-2'-(4-methoxyphenyl)-3'-[(4-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-1,3-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1ccc(cc1)OC)C(=O)c1c(C2=O)cccc1)cccc3

STK552289
Synonyms: (1'S,2'S,3R,3a'R)-1'-[(4-chlorophenyl)carbonyl]-2'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2c3ccccc3C=C[C@@H]2[C@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1

STK552290
Synonyms: (2E)-3-(4-chlorophenyl)-N-{[2-(pyridin-3-yl)piperidin-1-yl]carbamothioyl}prop-2-enamide
Smiles: S=C(NN1CCCCC1c1cccnc1)NC(=O)/C=C/c1ccc(cc1)Cl

STK552292
Synonyms: 3-[(3-amino-2,4,6-trinitrophenyl)amino]phenol
Smiles: Oc1cccc(c1)Nc1c(cc(c(c1[N+](=O)[O-])N)[N+](=O)[O-])[N+](=O)[O-]

STK552293
Synonyms: (8R,8aS,11aR)-8-(2,2-dimethylpropanoyl)-10-(3-fluorophenyl)-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)C1N([C@H]2C(=O)C(C)(C)C)N=Cc2c1cccc2

STK552295
Synonyms: 11-(4-fluorobenzyl)-2-methyl-3-(1-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Fc1ccc(cc1)Cn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C(c1ccccc1)C

STK552297
Synonyms: (2Z)-2-cyano-2-[(5Z)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(furan-2-ylmethyl)ethanamide
Smiles: N#C/C(=c\1/s/c(=C\c2ccc(o2)c2ccc(cc2)F)/c(=O)n1c1ccccc1)/C(=O)NCc1ccco1

STK552299
Synonyms: ethyl3-{[3-(3,5-dimethylpiperidin-1-yl)propanoyl]amino}-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CC(C)CC(C1)C)cc(cc2)OC

STK552300
Synonyms: 10-(2,4-dimethylphenyl)pyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
Smiles: Cc1ccc(c(c1)C)n1c2ccccc2cc2c1nc(=O)[nH]c2=O

STK552301
Synonyms: 4-(benzylsulfanyl)-2-phenyl-6-(propan-2-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CC(C1OCc2c(C1)c1c(SCc3ccccc3)nc(nc1s2)c1ccccc1)C

STK552302
Synonyms: ethyl3-methyl-5-phenoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1C)cc(cc2)Oc1ccccc1

STK552303
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(2,5-dimethoxyphenyl)carbonyl]-3'-(2,2-dimethylpropanoyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C)OC

STK552304
Synonyms: ethyl(2Z)-3,4-dihydroquinolin-1(2H)-yl[2-(3-methoxyphenyl)hydrazinylidene]ethanoate
Smiles: CCOC(=O)/C(=N/Nc1cccc(c1)OC)/N1CCCc2c1cccc2

STK552305
Synonyms: 10,10-dimethyl-5-(methylsulfanyl)-3-[(2-phenylethyl)sulfanyl]-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCCc1ccccc1)nn2)CC(OC3)(C)C

STK552306
Synonyms: 2-{1-[4-(2-methylpropyl)phenyl]ethyl}-1-(naphthalen-1-ylmethyl)-1H-benzimidazole
Smiles: CC(Cc1ccc(cc1)C(c1nc2c(n1Cc1cccc3c1cccc3)cccc2)C)C

STK552307
Synonyms: N-[3-(dimethylamino)-2-hydroxypropyl]-4-methyl-N-(3-nitrophenyl)benzenesulfonamide
Smiles: CN(CC(CN(S(=O)(=O)c1ccc(cc1)C)c1cccc(c1)[N+](=O)[O-])O)C

STK552308
Synonyms: 2-(4-chlorophenyl)-3-[4-(2-nitrophenoxy)butyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccccc1[N+](=O)[O-]

STK552309
Synonyms: 2-[(2Z)-2-(3,5-diphenylcyclohex-2-en-1-ylidene)hydrazinyl]-6-methyl-4-phenylquinazoline
Smiles: Cc1ccc2c(c1)c(nc(n2)N/N=C\1/CC(CC(=C1)c1ccccc1)c1ccccc1)c1ccccc1

STK552310
Synonyms: ethyl1-{[(phenylcarbonyl)carbamothioyl]amino}-5-(propan-2-yl)-7,8-dihydro-6H-cyclopenta[d]thieno[2,3-b]pyridine-2-carboxylate
Smiles: CCOC(=O)c1sc2c(c1NC(=S)NC(=O)c1ccccc1)c1CCCc1c(n2)C(C)C

STK552311
Synonyms: 4-[(E)-{2-[4-(4-chlorophenyl)piperazin-1-yl]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]phenylbenzenesulfonate
Smiles: Clc1ccc(cc1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OS(=O)(=O)c2ccccc2)/S1

STK552315
Synonyms: 3,3,6,6-tetramethyl-9-(1-methyl-1H-pyrazol-4-yl)-10-(pyridin-2-yl)-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Smiles: Cn1ncc(c1)C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)c1ccccn1

STK552316
Synonyms: N-(4-bromophenyl)-11-(4-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Fc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)Br)c1ccccc1

STK552317
Synonyms: (8S,8aR,11aS,11bS)-8-(2,2-dimethylpropanoyl)-10-(2-methyl-4-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Cc1cc(ccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2c2ccccc2C=C1)C(=O)C(C)(C)C)[N+](=O)[O-]

STK552318
Synonyms: ethyl(2Z)-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl][2-(3-methylphenyl)hydrazinylidene]ethanoate
Smiles: CCOC(=O)/C(=N/Nc1cccc(c1)C)/Sc1nnc(n1c1ccccc1)c1ccccc1

STK552319
Synonyms: 2-{[4-butyl-9-(methylsulfanyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: CCCCc1nc2sc3c(c2c2c1CCC2)nc(nc3SCC(=O)N(c1ccccc1)c1ccccc1)SC

STK552320
Synonyms: (6aS,6bR,9aS,10R)-8-(4-methylphenyl)-N-(4-nitrophenyl)-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)[N+](=O)[O-]

STK552321
Synonyms: 2-[(4-amino-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide
Smiles: O=C(CSc1nc(N)c2c(n1)sc1c2CC(OC1)(C)C)NCCc1ccccc1

STK552322
Synonyms: (5Z)-5-({1-[3-(3,5-dimethylphenoxy)propyl]-1H-indol-3-yl}methylidene)-1-(4-fluorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2cc(C)cc(c2)C)/C1=O

STK552327
Synonyms: 2-(3-oxo-3-phenylpropyl)cyclopentanone
Smiles: O=C1CCCC1CCC(=O)c1ccccc1

STK552328
Synonyms: 9'-bromo-1-methyl-2'-(pyridin-3-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1cccnc1)Br

STK552329
Synonyms: bis(2-methylpropyl)[(2,4-dichlorophenyl)(hydroxy)methyl]phosphonate
Smiles: CC(COP(=O)(C(c1ccc(cc1Cl)Cl)O)OCC(C)C)C

STK552330
Synonyms: 2-(2-{[10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: CSc1nc2sc3c(c2c2n1c(SCCN1C(=O)c4c(C1=O)cccc4)nn2)CC(OC3)(C)C

STK552331
Synonyms: 10-(2-methylphenyl)pyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
Smiles: O=c1[nH]c(=O)c2c(n1)n(c1ccccc1C)c1c(c2)cccc1

STK552333
Synonyms: 6,6-dimethyl-2-(methylsulfanyl)-4-[(naphthalen-2-ylmethyl)sulfanyl]-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CSc1nc(SCc2ccc3c(c2)cccc3)c2c(n1)sc1c2CC(OC1)(C)C

STK552334
Synonyms: (5Z)-5-({1-[2-(4-chlorophenoxy)ethyl]-1H-indol-3-yl}methylidene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2ccc(cc2)Cl)/C1=O

STK552335
Synonyms: 5-(2-chlorophenyl)-3-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl

STK552336
Synonyms: 3-[4-(dimethylamino)phenyl]-5-(naphthalen-1-yl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CN(c1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1cccc2c1cccc2)c1ccccc1)C

STK552337
Synonyms: 3-butyl-2-[(2-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCn1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK552339
Synonyms: 2-(butylsulfanyl)-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCn1c(SCCCC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552341
Synonyms: N-[(5Z)-5-(2,5-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-4-fluorobenzamide
Smiles: COc1ccc(cc1/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)F)OC

STK552345
Synonyms: (4aS,4bR,7aS,8R)-6-(naphthalen-2-yl)-8-[(3-nitrophenyl)carbonyl]-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: O=C1N(c2ccc3c(c2)cccc3)C(=O)[C@@H]2[C@H]1[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK552346
Synonyms: 12-(3-methylbutyl)-9-[(3-methylbutyl)sulfanyl]-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7(12H)-one
Smiles: CC(CCn1c2c3ccccc3CC3(c2c(=O)n2c1nnc2SCCC(C)C)CCCC3)C

STK552347
Synonyms: (9E)-9-(4-fluorobenzylidene)-5-(4-fluorophenyl)-7-methyl-3-(4-methylphenyl)-6,7,8,9-tetrahydro-5H-pyrido[4,3-d][1,3]thiazolo[3,2-a]pyrimidine
Smiles: CN1C/C(=C\c2ccc(cc2)F)/C2=C(C1)C(c1ccc(cc1)F)n1c(=N2)scc1c1ccc(cc1)C

STK552348
Synonyms: N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-2-oxopiperidine-3-carbohydrazide
Smiles: CN(c1ccc(cc1)/C=N/NC(=O)C1CCCNC1=O)C

STK552350
Synonyms: N-methyl-4-[(2,3,5,6-tetrafluoropyridin-4-yl)oxy]aniline
Smiles: CNc1ccc(cc1)Oc1c(F)c(F)nc(c1F)F

STK552351
Synonyms: N-(3,4-dimethylphenyl)-10-methyl-8-phenyl-11-(3,4,5-trimethoxyphenyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1c(OC)cc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)C)C)c1ccccc1

STK552353
Synonyms: N-(4-chlorophenyl)-2-{[5-(methylsulfanyl)-10-(propan-2-yl)-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: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)Cl)nn2)CC(OC3)C(C)C

STK552354
Synonyms: 1,6-bis(4-butoxyphenyl)-2,5-bis[(diethylamino)methyl]hexane-1,6-dione
Smiles: CCN(CC(C(=O)c1ccc(cc1)OCCCC)CCC(C(=O)c1ccc(cc1)OCCCC)CN(CC)CC)CC

STK552355
Synonyms: N~4~-benzyl-N~2~-(3-methoxypropyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: COCCCNc1nc(NCc2ccccc2)c(c(n1)N)[N+](=O)[O-]

STK552356
Synonyms: tert-butyl(2'R,3'R)-2'-(3-nitrophenyl)-1,3-dioxo-1,2',3,3'-tetrahydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-3'-carboxylate
Smiles: O=C([C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1cccc(c1)[N+](=O)[O-])C(=O)c1c(C2=O)cccc1)cccc3)OC(C)(C)C

STK552358
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-cyclohexylmethylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)N/N=C/C1CCCCC1

STK552360
Synonyms: 5-(4-chlorophenyl)-3-(4-hydroxyphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Oc1ccc(cc1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)c1ccc(cc1)Cl

STK552361
Synonyms: 2-imino-1-(2-methoxyethyl)-8-methyl-3-(phenylsulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Smiles: COCCn1c2nc3ccc(cn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccccc1)C

STK552362
Synonyms: (8R,8aS,11aR)-8-acetyl-10-(4-chlorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: CC(=O)[C@H]1[C@H]2C(=O)N(C(=O)[C@H]2C2N1N=Cc1c2cccc1)c1ccc(cc1)Cl

STK552363
Synonyms: 6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-1,3-bis(2-methylphenyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: Cc1ncc2c(c1O)C(OC2)c1c(O)n(c2ccccc2C)c(=S)n(c1=O)c1ccccc1C

STK552364
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}-N-phenylacetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552365
Synonyms: ethyl7-{[(3,5-dimethylpiperidin-1-yl)acetyl]amino}-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CC(C)CC(C1)C)cc1c(c2)OCO1

STK552366
Synonyms: 1-[5-(2-chlorophenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Smiles: CC(=O)N1N=C(CC1c1ccccc1Cl)c1ccccc1

STK552367
Synonyms: 3-(2-methoxyphenyl)-2-[(2-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccccc1n1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK552368
Synonyms: 1-(4-methylphenyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: Cc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccc(cc1)C

STK552370
Synonyms: (5Z)-3-(3,5-dichlorophenyl)-2-thioxo-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C/2\SC(=S)N(C2=O)c2cc(Cl)cc(c2)Cl)cc(c1OC)OC

STK552371
Synonyms: N,1-dibenzyl-2-imino-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: Cc1cccn2c1nc1n(Cc3ccccc3)c(=N)c(cc1c2=O)C(=O)NCc1ccccc1

STK552372
Synonyms: N'-[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]pyrazine-2-carbohydrazide
Smiles: C/C(=C\c1ccco1)/C=N/NC(=O)c1cnccn1

STK552373
Synonyms: 1-benzyl-2,5,6-triphenyl-1H-imidazo[1,2-a]imidazole
Smiles: c1ccc(cc1)Cn1c(cn2c1nc(c2c1ccccc1)c1ccccc1)c1ccccc1

STK552375
Synonyms: N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-nitrobenzamide
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])Nc1c(nc2n1cccc2C)c1ccccc1

STK552376
Synonyms: N-[2-hydroxy-6-methyl-4-(propan-2-yl)phenyl]thiophene-2-carboxamide
Smiles: CC(c1cc(C)c(c(c1)O)NC(=O)c1cccs1)C

STK552377
Synonyms: 2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N-(4-bromophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3

STK552378
Synonyms: 8-bromo-N-[2-(cyclohex-1-en-1-yl)ethyl]-5H-pyrimido[5,4-b]indol-4-amine
Smiles: Brc1ccc2c(c1)c1ncnc(c1[nH]2)NCCC1=CCCCC1

STK552379
Synonyms: (4aS,4bR,7aS,8R)-6-(2,4-dimethylphenyl)-8-[(3-nitrophenyl)carbonyl]-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK552380
Synonyms: N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]pyridine-2-carbohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)c1ccccn1)OC

STK552381
Synonyms: N~6~-(2,5-dichlorophenyl)-N~4~,N~4~-diethyl-7-nitro-2,1,3-benzoxadiazole-4,6-diamine
Smiles: CCN(c1cc(Nc2cc(Cl)ccc2Cl)c(c2c1non2)[N+](=O)[O-])CC

STK552383
Synonyms: 3-bromo-2-oxo-N-(pyridin-2-ylmethyl)-2H-pyran-5-carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)NCc1ccccn1

STK552384
Synonyms: 3-{2-[2-(2-bromo-4-chlorophenoxy)ethoxy]ethyl}-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1ccc(cc1Br)Cl

STK552385
Synonyms: (5Z)-5-{[1-(3,4-dichlorobenzyl)-1H-indol-3-yl]methylidene}-1-(4-fluorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccc(c(c2)Cl)Cl)/C1=O

STK552386
Synonyms: 2-{[2-(4-butoxyphenyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
Smiles: CCCCOc1ccc(cc1)c1nc(SCC(=O)c2ccc(cc2)F)c2c(n1)sc1c2CC(OC1)(C)C

STK552387
Synonyms: ethyl5-methyl-2-(propanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CC)sc2c1CC(C)CC2

STK552388
Synonyms: 1-[7-(3-bromophenyl)-3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinolin-2-yl]ethanone
Smiles: Brc1cccc(c1)C1C2CC=CC2c2c3N1CC1CC=CC1c3cc(c2)C(=O)C

STK552389
Synonyms: 8-[(2-chlorobenzyl)sulfanyl]-10-(methylsulfanyl)-5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CSc1nc(SCc2ccccc2Cl)c2c(n1)c1c(s2)nc(c2c1CCCC2)C(C)C

STK552390
Synonyms: 3-methyl-7-{[2-(3-methylpiperidin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: CC1CCCN(C1)CCNc1cc2oc3cc(C)ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1

STK552392
Synonyms: (5Z)-5-{[1-(2,6-dichlorobenzyl)-1H-indol-3-yl]methylidene}-1-(4-fluorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2c(Cl)cccc2Cl)/C1=O

STK552393
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK552395
Synonyms: 9-(4-chlorophenyl)-5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8(9H)-one
Smiles: Clc1ccc(cc1)n1cnc2c(c1=O)sc1c2c2CCCCc2c(n1)N1CCOCC1

STK552397
Synonyms: 5-(2-chlorophenyl)-3-(3-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Clc1ccccc1N1C(=O)C2C(C1=O)ON(C2c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK552398
Synonyms: (5E)-1-(2,4-dimethylphenyl)-5-(4-methoxy-3-nitrobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1C)C

STK552399
Synonyms: 2-(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}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1cccc(c1)C)SCCN1C(=O)c2c(C1=O)cccc2)C

STK552400
Synonyms: 2-{(2Z)-2-[(2E)-benzylidenehydrazinylidene]-4-oxo-1,3-thiazolidin-5-yl}-N-(4-chlorophenyl)acetamide
Smiles: O=C(CC1S/C(=N\N=C\c2ccccc2)/NC1=O)Nc1ccc(cc1)Cl

STK552401
Synonyms: 2-[(6,6-dimethyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(1-phenylpropan-2-yl)acetamide
Smiles: CC(Cc1ccccc1)NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)C

STK552402
Synonyms: [2-(4-methylphenyl)-1,3-thiazolidin-3-yl](4-nitrophenyl)methanone
Smiles: Cc1ccc(cc1)C1SCCN1C(=O)c1ccc(cc1)[N+](=O)[O-]

STK552404
Synonyms: N-[(2-hydroxy-7-methylquinolin-3-yl)methyl]-2-methyl-N-(2-methylphenyl)benzamide
Smiles: Cc1ccc2c(c1)nc(c(c2)CN(c1ccccc1C)C(=O)c1ccccc1C)O

STK552405
Synonyms: (2E)-2-cyano-N-(2,3-dimethylphenyl)-2-[5-(3-methylbenzyl)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: N#C/C(=C/1\SC(C(=O)N1c1ccccc1)Cc1cccc(c1)C)/C(=O)Nc1cccc(c1C)C

STK552406
Synonyms: 11-(1,3-benzodioxol-5-ylmethyl)-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc2c(c1)OCO2

STK552407
Synonyms: 4-(4-bromophenyl)-6-(tricyclo[3.3.1.1~3,7~]dec-2-yl)-3,4-dihydropyrimidine-2(1H)-thione
Smiles: S=C1NC(=CC(N1)c1ccc(cc1)Br)C1C2CC3CC1CC(C2)C3

STK552408
Synonyms: 3-(2-methoxyphenyl)-2-[(3-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccccc1n1c(SCc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK552409
Synonyms: (5Z)-3-(2-bromophenyl)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)c1ccccc1Br

STK552410
Synonyms: 2-(2-fluorophenyl)-4-(naphthalen-1-yloxy)quinazoline
Smiles: Fc1ccccc1c1nc(Oc2cccc3c2cccc3)c2c(n1)cccc2

STK552411
Synonyms: 11-(5-bromofuran-2-yl)-N-(3-chloro-4-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(o2)Br)c(nn1c1ccccc1)C

STK552412
Synonyms: 4-[(Z)-2-cyano-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}ethenyl]-2-methoxyphenylacetate
Smiles: N#C/C(=C/c1ccc(c(c1)OC)OC(=O)C)/c1scc(n1)c1ccc(cc1)CC(C)C

STK552413
Synonyms: 10-butyl-3-(methylsulfanyl)-7,8,9,11a-tetrahydro-6bH-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncn1c3nnc1SC

STK552414
Synonyms: (8R,8aS,11aR)-10-(2,4-dichlorophenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1Cl)Cl)cccc3

STK552416
Synonyms: (5Z)-1-[4-(butan-2-yl)phenyl]-5-{[1-(2-fluorobenzyl)-1H-indol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccccc2F)/C1=O)C

STK552417
Synonyms: (5E)-1-(2,5-dimethylphenyl)-5-(furan-2-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\c2ccco2)/C1=O)C

STK552423
Synonyms: 12-(2-methylprop-2-en-1-yl)-9-[(2-methylprop-2-en-1-yl)sulfanyl]-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7(12H)-one
Smiles: CC(=C)Cn1c2c3ccccc3CC3(c2c(=O)n2c1nnc2SCC(=C)C)CCCC3

STK552424
Synonyms: 4-[(8R,8aS,11aR)-8-[(4-methoxyphenyl)carbonyl]-9,11-dioxo-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazin-10(11H)-yl]phenylacetate
Smiles: COc1ccc(cc1)C(=O)[C@H]1[C@H]2C(=O)N(C(=O)[C@H]2C2N1N=Cc1c2cccc1)c1ccc(cc1)OC(=O)C

STK552426
Synonyms: 1-methoxypropan-2-yl2-amino-1-(2,3-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCC(OC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1C)C)C

STK552428
Synonyms: N-{3-[bis(2-methylpropyl)amino]-2-hydroxypropyl}-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)CC(CN(CC(C)C)CC(C)C)O

STK552429
Synonyms: 3-(4-methylphenyl)-3-[4-(propan-2-yloxy)phenyl]propanimidicacid
Smiles: OC(=N)CC(c1ccc(cc1)C)c1ccc(cc1)OC(C)C

STK552431
Synonyms: 4-[4-(2,4-diphenyl-1H-imidazol-5-yl)phenyl]-2,5-diphenyl-1H-imidazole
Smiles: c1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)c1[nH]c(nc1c1ccccc1)c1ccccc1)c1ccccc1

STK552432
Synonyms: 2-(4-benzylpiperazin-1-yl)-N'-[(1E)-1-(biphenyl-4-yl)ethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1)N/N=C(/c1ccc(cc1)c1ccccc1)\C

STK552433
Synonyms: 4-(4-tert-butylphenoxy)-2-(pyridin-2-yl)quinazoline
Smiles: CC(c1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccccn1)(C)C

STK552434
Synonyms: (2E)-2-(5-benzyl-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene)-2-cyano-N-(4-ethylphenyl)ethanamide
Smiles: CCc1ccc(cc1)NC(=O)/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1ccccc1)/C#N

STK552435
Synonyms: 3,5-diethyl-2-[(3-hydroxypropyl)amino]-5-methyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: OCCCNc1nc2c3ccccc3CC(c2c(=O)n1CC)(C)CC

STK552437
Synonyms: 2-{4-[(4-chlorophenyl)amino]quinazolin-2-yl}-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Nc2ccc(cc2)Cl)c2c(n1)cccc2

STK552439
Synonyms: 2-(4-butoxyphenyl)-4-[(4-fluorobenzyl)sulfanyl]-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCc2ccc(cc2)F)c2c(n1)sc1c2CC(OC1)(C)C

STK552442
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{2-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}methylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1OCc1ccccc1Cl)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N

STK552443
Synonyms: (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-[(3,4,5-trimethoxyphenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1cccc(c1)Br

STK552444
Synonyms: N-(2-methoxy-5-methylphenyl)-2-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(s1)SCc1cccc2c1cccc2)C

STK552445
Synonyms: 2-(4-benzylpiperazin-1-yl)-N'-[(1Z)-1-(4-chlorophenyl)ethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1)N/N=C(\c1ccc(cc1)Cl)/C

STK552448
Synonyms: 5-(4-ethylphenyl)-3-(3-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK552449
Synonyms: (9E)-9-(4-chlorobenzylidene)-5-(4-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-methyl-6,7,8,9-tetrahydro-5H-pyrido[4,3-d][1,3]thiazolo[3,2-a]pyrimidine
Smiles: CN1C/C(=C\c2ccc(cc2)Cl)/C2=C(C1)C(c1ccc(cc1)Cl)n1c(=N2)scc1c1ccc2c(c1)OCCO2

STK552450
Synonyms: (8R,8aS,11aR)-8-[(4-methoxyphenyl)carbonyl]-10-(naphthalen-2-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc2c(c1)cccc2)cccc3

STK552451
Synonyms: (5Z)-1-(3-chloro-4-methylphenyl)-5-({1-[2-(3,5-dimethylphenoxy)ethyl]-1H-indol-3-yl}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1cc(OCCn2cc(c3c2cccc3)/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(c(c2)Cl)C)cc(c1)C

STK552452
Synonyms: 4-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-2-(2-fluorophenyl)quinazoline
Smiles: Clc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1F

STK552454
Synonyms: N-(4-phenylbutan-2-yl)-2-[(2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)sulfanyl]acetamide
Smiles: CC(NC(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C)CCc1ccccc1

STK552455
Synonyms: 2-[4-(4-nitrophenoxy)quinazolin-2-yl]phenol
Smiles: Oc1ccccc1c1nc(Oc2ccc(cc2)[N+](=O)[O-])c2c(n1)cccc2

STK552457
Synonyms: 2-amino-1-(2-methylpropyl)-N-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CC(Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccccc1)C

STK552458
Synonyms: (8R,8aS,11aR)-10-(1,3-benzodioxol-5-yl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc2c(c1)OCO2)cccc3

STK552459
Synonyms: 3-{[(E)-(4-fluorophenyl)methylidene]amino}-8-methoxy-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1nc(C)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)F

STK552460
Synonyms: ethyl7-({[4-(3-chlorophenyl)piperazin-1-yl]acetyl}amino)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)Cl)cc1c(c2)OCO1

STK552462
Synonyms: 11-(4-butylphenyl)-2-methyl-3-(tetrahydrofuran-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)CC1CCCO1

STK552463
Synonyms: 4-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-2-[4-(propan-2-yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(N/N=C/c2ccc(cc2)Cl)c2c(n1)cccc2)C

STK552464
Synonyms: ethyl3-({3-[4-(3-chlorophenyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1)Cl)cccc2

STK552465
Synonyms: 3-methyl-7-{[2-(2-methylpiperidin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: Cc1ccc2c(c1)oc1c([nH]2)c2c(c(c1)NCCN1CCCCC1C)c(=O)c1c(c2=O)cccc1

STK552466
Synonyms: N-[(1E)-1-[4-(dimethylamino)phenyl]-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl]-4-methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)N/C(=C/c1ccc(cc1)N(C)C)/C(=O)NCCc1c[nH]c2c1cccc2

STK552467
Synonyms: 7-(4-methylphenyl)-3-(3-nitrophenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: Cc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1cccc(c1)[N+](=O)[O-]

STK552469
Synonyms: 4,4'-{sulfonylbis[(6-chlorobenzene-3,1-diyl)sulfonyl]}dimorpholine
Smiles: Clc1ccc(cc1S(=O)(=O)N1CCOCC1)S(=O)(=O)c1ccc(c(c1)S(=O)(=O)N1CCOCC1)Cl

STK552470
Synonyms: 2-[(3-ethyl-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)n1CC)CCCCC3

STK552471
Synonyms: 7-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: O=c1c2ccccc2c(=O)c2c1c1[nH]c3ccccc3oc1cc2NCCN1CCN(CC1)Cc1ccccc1

STK552473
Synonyms: (8R,8aS,11aR)-8-(2,2-dimethylpropanoyl)-10-(4-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1[C@@H](N1C2c2ccccc2C=N1)C(=O)C(C)(C)C

STK552476
Synonyms: 2-[(4-bromobenzyl)sulfanyl]-6,6-dimethyl-3-(3-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Cc1cccc(c1)n1c(SCc2ccc(cc2)Br)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552477
Synonyms: 2-({5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N'-[(E)-(2-methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK552478
Synonyms: N-(3-chloro-4-methylphenyl)-11-(4-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Fc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)C)c1ccccc1

STK552479
Synonyms: ethyl4-{2-[(E)-2-(2-hydroxyphenyl)ethenyl]-6-iodo-4-oxoquinazolin-3(4H)-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2ccccc2O)nc2c(c1=O)cc(cc2)I

STK552480
Synonyms: 11-(3-chlorophenyl)-N-(2,4-dimethoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Cl)c(nn1c1ccccc1)C

STK552481
Synonyms: 2-(4-chlorophenyl)-3-[5-(4-iodophenoxy)pentyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1ccc(cc1)I

STK552482
Synonyms: (1'S,2'S,3R,3a'R)-1'-(2,2-dimethylpropanoyl)-2'-[(4-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

STK552483
Synonyms: (5Z)-2-[(2-chlorophenyl)amino]-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1cc(/C=C/2\SC(=NC2=O)Nc2ccccc2Cl)cc(c1OC)OC

STK552484
Synonyms: (2'R,3'R)-2'-(2,5-dimethoxyphenyl)-3'-[(4-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-1,3-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1cc(OC)ccc1OC)C(=O)c1c(C2=O)cccc1)cccc3

STK552485
Synonyms: 6-chloro-N-[(2-methoxydibenzo[b,d]furan-3-yl)carbamothioyl]pyridine-3-carboxamide
Smiles: COc1cc2c(cc1NC(=S)NC(=O)c1ccc(nc1)Cl)oc1c2cccc1

STK552486
Synonyms: 7-{[2-(4-methylpiperazin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: CN1CCN(CC1)CCNc1cc2oc3ccccc3[nH]c2c2c1c(=O)c1ccccc1c2=O

STK552487
Synonyms: N,N-dimethyl-N'-(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)propane-1,3-diamine
Smiles: CN(CCCNc1ncnc2c1[nH]c1c2cc(cc1)C)C

STK552488
Synonyms: 2-[(2-chlorobenzyl)sulfanyl]-6,6-dimethyl-3-(3-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Cc1cccc(c1)n1c(SCc2ccccc2Cl)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552489
Synonyms: 2-(butylsulfanyl)-6-propyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: CCCCSc1nc(N)c2c(n1)sc1c2CC(OC1)CCC

STK552491
Synonyms: 3-[(3-fluorobenzyl)sulfanyl]-10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1cccc(c1)F)nn2)CC(OC3)(C)C

STK552493
Synonyms: 2-{[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]pyrimidin-8-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK552494
Synonyms: 2-(diethylamino)ethyl4-({(Z)-2-cyano-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C\Nc1ccc(cc1)C(=O)OCCN(CC)CC)/C#N

STK552496
Synonyms: N-(4-methoxyphenyl)-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3

STK552497
Synonyms: (5E)-5-[(1-acetyl-1H-indol-3-yl)methylidene]-1-(3-chloro-4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)/C(=C\c2cn(c3c2cccc3)C(=O)C)/C(=O)N1c1ccc(c(c1)Cl)C

STK552499
Synonyms: 4-(2,4-dichlorophenyl)-N,N-diethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxamide
Smiles: CCN(C(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1Cl)Cl)CC

STK552502
Synonyms: ethyl2-{[6-iodo-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}propanoate
Smiles: CCOC(=O)C(Sc1nc2ccc(cc2c(=O)n1c1ccc(cc1)OC)I)C

STK552504
Synonyms: 2-(4-chloro-3-fluorophenyl)-3a,4,7,7a-tetrahydro-1H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione
Smiles: O=C1N(c2ccc(c(c2)F)Cl)C(=O)C2C1C1C=CC2C21CC2

STK552505
Synonyms: 2-[(E)-2-(4-hydroxyphenyl)ethenyl]-6-iodo-3-(4-nitrophenyl)quinazolin-4(3H)-one
Smiles: Oc1ccc(cc1)/C=C/c1nc2ccc(cc2c(=O)n1c1ccc(cc1)[N+](=O)[O-])I

STK552507
Synonyms: 3-chloro-N-[(3-chloro-1-benzothiophen-2-yl)carbonyl]-N-(4,6-dimethylpyrimidin-2-yl)-1-benzothiophene-2-carboxamide
Smiles: Cc1cc(C)nc(n1)N(C(=O)c1sc2c(c1Cl)cccc2)C(=O)c1sc2c(c1Cl)cccc2

STK552508
Synonyms: methyl1-acetyl-7-(3,4-dichlorophenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Smiles: COC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(c(c1)Cl)Cl)C(=O)C

STK552509
Synonyms: 4-{(1E)-1-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]ethyl}phenylbenzoate
Smiles: CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)OC(=O)c1ccccc1)\C

STK552510
Synonyms: (2E)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-[(3,4,5-trimethoxyphenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1ccc(c(c1)OC)OC

STK552511
Synonyms: (8S,8aR,11aS,11bS)-10-(2,4-dimethoxyphenyl)-8-(2,2-dimethylpropanoyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(c(c1)OC)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2c2ccccc2C=C1)C(=O)C(C)(C)C

STK552512
Synonyms: dimethyl5-({(Z)-2-cyano-2-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)benzene-1,3-dicarboxylate
Smiles: N#C/C(=C/Nc1cc(cc(c1)C(=O)OC)C(=O)OC)/c1scc(n1)c1cccs1

STK552513
Synonyms: 9-bromo-2-(furan-2-yl)-5-(3-nitrophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: Brc1ccc2c(c1)C1CC(=NN1C(O2)c1cccc(c1)[N+](=O)[O-])c1ccco1

STK552514
Synonyms: ethyl3-{[3-(3,5-dimethylpiperidin-1-yl)propanoyl]amino}-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CC(C)CC(C1)C)cc(c(c2)OC)OC

STK552515
Synonyms: 2-[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-5-methoxyphenylmorpholine-4-carboxylate
Smiles: COc1ccc(c(c1)OC(=O)N1CCOCC1)C(=O)/C=C/c1ccc(c(c1)OC)OC

STK552516
Synonyms: (1'R,2'S,7a'S)-2'-[(4-fluorophenyl)carbonyl]-5',6',7',7a'-tetrahydrodispiro[indene-2,3'-pyrrolizine-1',3''-indole]-1,2'',3(1''H)-trione
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@@]2(C(=O)c3c(C2=O)cccc3)N2[C@H]([C@]31C(=O)Nc1c3cccc1)CCC2

STK552518
Synonyms: 11-(3,4-dichlorophenyl)-N-(3,4-dimethylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1nn(c2c1C(c1ccc(c(c1)Cl)Cl)n1c(=N2)c(Nc2ccc(c(c2)C)C)nc2c1cccc2)c1ccccc1

STK552519
Synonyms: 2-[4-(3-methylbutoxy)phenyl]-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]
Smiles: CC(CCOc1ccc(cc1)c1nn2c(n1)c1c(nc2)c2ccccc2CC21CCCCC2)C

STK552522
Synonyms: 2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N,N-dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3)CCC

STK552523
Synonyms: N-(2-ethoxyphenyl)-11-(2-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2F)c(nn1c1ccccc1)C

STK552524
Synonyms: 2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-1-(3,4-dimethoxyphenyl)ethanone
Smiles: COc1cc(ccc1OC)C(=O)CSc1nnc(s1)SCc1ccccc1

STK552525
Synonyms: 2-(4-chlorophenyl)-3-[5-(3-phenoxyphenoxy)pentyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1cccc(c1)Oc1ccccc1