FULL DB

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

STK546510
Synonyms: (3S)-2-(3-bromo-4-methoxyphenyl)-3-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)cyclopropane-1,1-dicarbonitrile
Smiles: N#CC1(C#N)C([C@@H]1C(=O)C12CC3CC(C2)CC(C1)C3)c1ccc(c(c1)Br)OC

STK546511
Synonyms: 5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(4-hydroxyphenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1OC)C1N(c2ccc(cc2)O)C(=O)C(=C1C(=O)c1ccccc1)O

STK546512
Synonyms: butylcyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
Smiles: CCCCOC(=O)C(c1nc2ccccc2nc1N1CCC(CC1)C)C#N

STK546513
Synonyms: 3-chloro-1-(2-ethylphenyl)-4-[(4-fluorophenyl)amino]-1H-pyrrole-2,5-dione
Smiles: CCc1ccccc1N1C(=O)C(=C(C1=O)Cl)Nc1ccc(cc1)F

STK546515
Synonyms: (8S,8aR)-6-amino-8-(4-chlorophenyl)-2-(2-phenylethyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)CCc1ccccc1)c1ccc(cc1)Cl)(C#N)C#N

STK546516
Synonyms: N,N-diethyl-2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3)CC

STK546517
Synonyms: 2-{[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(3-chloro-4-fluorophenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(c(c2)Cl)F)nc(c(c1c1cccs1)C#N)N

STK546518
Synonyms: [(4-chlorophenyl)sulfonyl][3-(morpholin-4-yl)quinoxalin-2-yl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)Cl)c1nc2ccccc2nc1N1CCOCC1

STK546519
Synonyms: 2-acetyl-N-(3,4-dimethyl-2-thioxo-2,3-dihydro-1,3-thiazol-5-yl)hydrazinecarboxamide
Smiles: O=C(Nc1sc(=S)n(c1C)C)NNC(=O)C

STK546520
Synonyms: 2-{[2-(dimethylamino)ethyl]sulfanyl}-5-heptyl-6-hydroxypyrimidin-4(3H)-one
Smiles: CCCCCCCc1c(O)nc([nH]c1=O)SCCN(C)C

STK546521
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-methoxy-3-[(2,4,6-trichlorophenoxy)methyl]phenyl}methylidene]-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1COc1c(Cl)cc(cc1Cl)Cl)/C=N/NC(=O)c1nnn(c1CN1CCN(CC1)C)c1nonc1N

STK546522
Synonyms: 2-(4-methoxyphenyl)-3-{2-[2-(propan-2-yloxy)phenoxy]ethyl}quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccccc1OC(C)C

STK546523
Synonyms: N-[(2E)-3,4-dihydroquinolin-2(1H)-ylidene]-1-phenylmethanamine
Smiles: c1ccc(cc1)C/N=C/1\CCc2c(N1)cccc2

STK546525
Synonyms: 1-hexadecyl-3-hydroxy-5-(4-methoxyphenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCCCCCCCCCCCCCN1C(=O)C(=C(C1c1ccc(cc1)OC)C(=O)c1ccccc1)O

STK546526
Synonyms: butyl{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}(cyano)acetate
Smiles: CCCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)C#N

STK546527
Synonyms: 4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole
Smiles: C1CCN(C1)c1ncnc2c1[nH]c1c2cccc1

STK546528
Synonyms: 2-(4-methoxyphenyl)-3-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(C)ccc1C(C)C

STK546530
Synonyms: 4-acetyl-1-benzyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1OC)C1N(Cc2ccccc2)C(=O)C(=C1C(=O)C)O

STK546532
Synonyms: 2-butyl-3-methyl-1-[4-(6-methylpyridin-2-yl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)c1cccc(n1)C)c1ccccc1n2

STK546533
Synonyms: 5-hexyl-6-hydroxy-2-{[2-(morpholin-4-yl)ethyl]sulfanyl}-3-phenylpyrimidin-4(3H)-one
Smiles: CCCCCCc1c(O)nc(n(c1=O)c1ccccc1)SCCN1CCOCC1

STK546535
Synonyms: methyl4-{6-[(2,4-dimethylphenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(cc1C)C)nc1c2cccc1

STK546536
Synonyms: 3-amino-6-ethyl-N-[4-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)Nc1ccc(cc1)C(F)(F)F

STK546537
Synonyms: ethyl4,5-dimethyl-2-({[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonyl]carbamothioyl}amino)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2c(C)onc2c2ccccc2)sc(c1C)C

STK546538
Synonyms: 4-hydroxy-N'-[(E)-(2-hydroxyphenyl)methylidene]-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)benzohydrazide
Smiles: O=C(c1ccc(c(c1)C12CC3CC(C2)CC(C1)C3)O)N/N=C/c1ccccc1O

STK546539
Synonyms: 2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(s1)SCc1ccccc1

STK546541
Synonyms: [(4-bromophenyl)sulfonyl]{3-[1-(3-methylbutyl)-1H-imidazol-3-ium-3-yl]-1,4-dioxo-1,4-dihydronaphthalen-2-yl}azanide
Smiles: CC(CCn1cc[n+](c1)C1=C([N-]S(=O)(=O)c2ccc(cc2)Br)C(=O)c2c(C1=O)cccc2)C

STK546543
Synonyms: 2,6-dimethylphenyldiphenylacetate
Smiles: O=C(C(c1ccccc1)c1ccccc1)Oc1c(C)cccc1C

STK546544
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]acetamide
Smiles: N#Cc1cc2CCCCCc2nc1SCC(=O)Nc1sc2c(c1C#N)CCC2

STK546545
Synonyms: N,N-dibutyl-2-{[4-oxo-3-(2-phenylethyl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3)CCCC

STK546546
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}methylidene]-5-(phenoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1CSc1nc2c(s1)cccc2)/C=N/NC(=O)c1nnn(c1COc1ccccc1)c1nonc1N

STK546547
Synonyms: 2-[(3-chlorobenzyl)sulfanyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Smiles: N#Cc1cc2CCCCCc2nc1SCc1cccc(c1)Cl

STK546548
Synonyms: (2E)-N-({4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}carbamothioyl)-3-(4-methylphenyl)prop-2-enamide
Smiles: CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)C

STK546549
Synonyms: 2-(morpholin-4-yl)-6-phenylpyrimidine-4-carboxamide
Smiles: NC(=O)c1nc(nc(c1)c1ccccc1)N1CCOCC1

STK546550
Synonyms: prop-2-en-1-yl2,3-dimethyl-4-oxo-4,5-dihydrothieno[3'',2'':5',6']pyrimido[1',2':1,5]pyrrolo[2,3-b]quinoxaline-6-carboxylate
Smiles: C=CCOC(=O)c1c2nc3ccccc3nc2n2c1[nH]c(=O)c1c2sc(c1C)C

STK546551
Synonyms: 5-(4-{[4-methoxy-3-(piperidin-1-ylcarbonyl)phenyl]amino}phthalazin-1-yl)-2-methylbenzenesulfonamide
Smiles: COc1ccc(cc1C(=O)N1CCCCC1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N)C

STK546552
Synonyms: ethyl2-[(3-{[(4-fluorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(cc2)F)sc2c1CCC(C2)C

STK546553
Synonyms: 3''-amino-8'',8a''-dihydrotrispiro[1,3-dioxolane-2,1'-cyclohexane-4',1''-naphthalene-7'',2'''-[1,3]dioxolane]-2'',2'',4''(6''H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C2(C3C1=CCC1(C3)OCCO1)CCC1(CC2)OCCO1)(C#N)C#N

STK546554
Synonyms: 2-[(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Smiles: CCCCn1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546555
Synonyms: 1-benzyl-2-imino-N-(2-methoxyethyl)-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: COCCNC(=O)c1cc2c(n(c1=N)Cc1ccccc1)nc1n(c2=O)cccc1C

STK546557
Synonyms: 2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-phenylacetamide
Smiles: CCCn1c(SCC(=O)Nc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546558
Synonyms: ethyl2-amino-5-cyano-6-[(3,4-dichlorobenzyl)sulfanyl]pyridine-3-carboxylate
Smiles: CCOC(=O)c1cc(C#N)c(nc1N)SCc1ccc(c(c1)Cl)Cl

STK546560
Synonyms: N-(2-{[3-(3,6-dichloro-9H-carbazol-9-yl)-2-hydroxypropyl][(4-methylphenyl)sulfonyl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccccc1N(S(=O)(=O)c1ccc(cc1)C)CC(Cn1c2ccc(cc2c2c1ccc(c2)Cl)Cl)O

STK546562
Synonyms: 4-(phenylcarbonyl)phenyl(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]quinoline-10-carboxylate
Smiles: O=C([C@H]1[C@@H]2[C@H]([C@H]3N1c1ccccc1C=C3)C(=O)N(C2=O)c1ccc(cc1)Cl)Oc1ccc(cc1)C(=O)c1ccccc1

STK546563
Synonyms: 8-{[cyclohexyl(methyl)amino]methyl}-7-hydroxy-3-(3-methylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CN(C1CCCCC1)Cc1c(O)ccc2c1oc(c(c2=O)Oc1cccc(c1)C)C(F)(F)F

STK546565
Synonyms: 2-[(2-benzyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N,N-dibutylacetamide
Smiles: CCCCN(C(=O)CSc1nc(Cc2ccccc2)nc2c1c1CC(C)(C)OCc1s2)CCCC

STK546566
Synonyms: 1-(4-chlorophenyl)-2-[(5-ethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]ethanone
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)Cl)nn2)CCCC3

STK546567
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetamide
Smiles: N#Cc1c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nc2c(c1c1ccccc1)CCC2

STK546568
Synonyms: 2-amino-6-[(3-fluorobenzyl)sulfanyl]-4-(thiophen-2-yl)pyridine-3,5-dicarbonitrile
Smiles: N#Cc1c(SCc2cccc(c2)F)nc(c(c1c1cccs1)C#N)N

STK546569
Synonyms: methyl(1R,2R,3R,3aS)-3-cyano-2-(furan-2-yl)-1-(phenylcarbonyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Smiles: COC(=O)[C@]1(C#N)[C@@H](c2ccco2)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccccc1

STK546571
Synonyms: 2-[(3,7-dibenzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCN(C3)Cc1ccccc1

STK546572
Synonyms: N-(2,5-dimethylphenyl)-10-methyl-11-(3-nitrophenyl)-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1ccc(c(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccc(c1)[N+](=O)[O-])C)c1ccccc1)C

STK546573
Synonyms: 2-[(4-methylbenzyl)sulfanyl]-3-(4-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCC3

STK546575
Synonyms: (1'R,2'R)-1'-[(4-chlorophenyl)carbonyl]-2'-phenyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccccc1)C(=O)c1c(C2=O)cccc1

STK546576
Synonyms: 3-{3-[4-(butan-2-yl)phenoxy]propyl}-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: CCC(c1ccc(cc1)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC)C

STK546577
Synonyms: (5E)-5-{2-[(4-nitrobenzyl)oxy]benzylidene}-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1ccccc1

STK546578
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2E)-butan-2-ylidene]-5-(morpholin-4-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CC/C(=N/NC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N)/C

STK546579
Synonyms: 4-[(1E)-1-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]-2-methoxyphenyl4-chlorobenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)Cl)/C(=N/NC(=O)c1nnn(c1C)c1nonc1N)/C

STK546580
Synonyms: [(4-methylphenyl)sulfonyl][3-(4-phenylpiperazin-1-yl)quinoxalin-2-yl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCN(CC1)c1ccccc1

STK546581
Synonyms: 6-amino-4-(2-chloroquinolin-3-yl)-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc3ccccc3nc1Cl)c([nH]n2)c1ccccc1

STK546582
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCn1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546583
Synonyms: 2-{[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(2-chlorophenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccccc2Cl)nc(c(c1c1cccs1)C#N)N

STK546584
Synonyms: {[4-(acetylamino)phenyl]sulfonyl}(3-{4-[(thiophen-2-ylcarbonyl)amino]pyridinium-1-yl}quinoxalin-2-yl)azanide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)NC(=O)c1cccs1

STK546585
Synonyms: prop-2-en-1-yl2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CC(C)C

STK546586
Synonyms: [3-amino-6-methyl-4-(thiophen-2-yl)thieno[2,3-b]pyridin-2-yl](tricyclo[3.3.1.1~3,7~]dec-1-yl)methanone
Smiles: Cc1nc2sc(c(c2c(c1)c1cccs1)N)C(=O)C12CC3CC(C2)CC(C1)C3

STK546587
Synonyms: prop-2-en-1-yl2-amino-1-(3-methoxypropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCCn1c2nc3ccccc3nc2c(c1N)C(=O)OCC=C

STK546589
Synonyms: 2-(piperidin-1-yl)anthracene-1,4-dione
Smiles: O=C1C=C(N2CCCCC2)C(=O)c2c1cc1ccccc1c2

STK546591
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-[2-(trifluoromethyl)phenyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)cccc3

STK546592
Synonyms: ethyl2-[({[3-cyano-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc(ccc2C#N)c2cccs2)sc2c1CCCC2

STK546595
Synonyms: N,N-diethyl-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3)CC

STK546597
Synonyms: (6aS,6bR,9aS,10R)-10-(1H-benzotriazol-1-ylcarbonyl)-8-(3,5-dichlorophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1N([C@H]2C(=O)n2nnc3c2cccc3)c2ccccc2C=C1

STK546600
Synonyms: N,N-dibutyl-2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3)CCCC

STK546601
Synonyms: 11-(4-chlorophenyl)-10-methyl-N-(4-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)Cl)C)c1ccccc1

STK546602
Synonyms: 3-hydroxy-1-methyl-5-(2-nitrophenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=C(C(N1C)c1ccccc1[N+](=O)[O-])C(=O)c1ccccc1)O

STK546606
Synonyms: diethyl{(phenylamino)[2-(trifluoromethyl)phenyl]methyl}phosphonate
Smiles: CCOP(=O)(C(c1ccccc1C(F)(F)F)Nc1ccccc1)OCC

STK546607
Synonyms: 3-(3,5-dimethylphenyl)-11-(2-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccccc1n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK546608
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}methylidene]-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc1OCc1ccc(cc1)F

STK546609
Synonyms: 2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3)NCCc1ccccc1

STK546610
Synonyms: 2-{[6-iodo-3-(2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2ccc(cc2c(=O)n1c1ccccc1C)I

STK546611
Synonyms: 1-methoxypropan-2-ylcyano[3-(dibutylamino)quinoxalin-2-yl]acetate
Smiles: CCCCN(c1nc2ccccc2nc1C(C(=O)OC(COC)C)C#N)CCCC

STK546612
Synonyms: [(4-bromophenyl)sulfonyl][3-(3-methylpyridinium-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2cccc(c2)C)C(=O)c2c(C1=O)cccc2

STK546613
Synonyms: 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-(4-bromophenyl)-6-iodoquinazolin-4(3H)-one
Smiles: Brc1ccc(cc1)n1c(/C=C/c2ccc3c(c2)OCO3)nc2c(c1=O)cc(cc2)I

STK546614
Synonyms: 3-hydroxy-1-(2-hydroxyethyl)-4-[(4-methylphenyl)carbonyl]-5-(2-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: OCCN1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)c1ccc(cc1)C)O

STK546615
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylamino)methyl]-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(OC)c(cc1OC)OC)CC

STK546616
Synonyms: 2-{[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-tert-butylacetamide
Smiles: N#Cc1c(SCC(=O)NC(C)(C)C)nc(c(c1c1cccs1)C#N)N

STK546617
Synonyms: N-[(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
Smiles: N#Cc1c(NC(=S)NC(=O)c2cc(OC)c(c(c2)OC)OC)sc2c1CCCCCC2

STK546618
Synonyms: 1-butyl-4-[(4-chlorophenyl)carbonyl]-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCN1C(c2ccc(cc2)OC)C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK546620
Synonyms: 1,3-bis(2-methoxyphenyl)-5-[(morpholin-4-ylamino)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccccc1N1C(=O)/C(=C/NN2CCOCC2)/C(=O)N(C1=S)c1ccccc1OC

STK546621
Synonyms: 2-(4-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylamino)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}phenoxy)acetamide
Smiles: NC(=O)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK546622
Synonyms: (2E)-3-(4-fluorophenyl)-N-{[4-(2-methoxyphenyl)piperazin-1-yl]carbonothioyl}prop-2-enamide
Smiles: COc1ccccc1N1CCN(CC1)C(=S)NC(=O)/C=C/c1ccc(cc1)F

STK546623
Synonyms: 1-methoxypropan-2-yl2-amino-1-(4-hydroxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)O)C

STK546624
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(2-fluorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1F)cccc3

STK546625
Synonyms: butyl2-amino-1-(3-chloro-4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)OC

STK546626
Synonyms: N,N-diethyl-2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)N(CC)CC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546627
Synonyms: ethyl4-cyano-5-({[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetyl}amino)-3-methylthiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nc(C)cc(c1C#N)C

STK546628
Synonyms: N-(3-chloro-4-fluorophenyl)-11-(2-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Fc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)F)c1ccccc1

STK546630
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-N'-{(E)-[3-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1cccc(c1)C(F)(F)F

STK546631
Synonyms: N-(3-chloro-4-methoxyphenyl)-11-(4-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)F)c(nn1c1ccccc1)C

STK546632
Synonyms: (5E)-2-[4-(4-methylphenyl)piperazin-1-yl]-5-{4-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazol-4(5H)-one
Smiles: Cc1ccc(cc1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OCc2ccc(cc2)[N+](=O)[O-])/S1

STK546634
Synonyms: propan-2-yl2-amino-1-[2-(4-methoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COc1ccc(cc1)CCn1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK546635
Synonyms: bis[2-(3,4-dimethoxyphenyl)-2-oxoethyl]cyanocarbonodithioimidate
Smiles: N#C/N=C(/SCC(=O)c1ccc(c(c1)OC)OC)\SCC(=O)c1ccc(c(c1)OC)OC

STK546636
Synonyms: 1-benzyl-5-(4-fluorophenyl)-3-hydroxy-4-[(4-nitrophenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)C1C(=C(C(=O)N1Cc1ccccc1)O)C(=O)c1ccc(cc1)[N+](=O)[O-]

STK546639
Synonyms: ethyl4-({[2-amino-1-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxalin-3-yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)OC

STK546640
Synonyms: ethyl(2E,3E)-3-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)-2-(hydroxyimino)butanoate
Smiles: C/C(=N\NC(=O)c1nnn(c1C)c1nonc1N)/C(=N\O)/C(=O)OCC

STK546641
Synonyms: N-[1-(1-benzyl-1H-benzimidazol-2-yl)butyl]benzamide
Smiles: CCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)c1ccccc1

STK546643
Synonyms: 3-methyl-2-(prop-2-en-1-yl)-1-[4-(pyridin-2-yl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: C=CCc1c(C)c(C#N)c2n(c1N1CCN(CC1)c1ccccn1)c1ccccc1n2

STK546644
Synonyms: N-(3-chlorophenyl)-11-(4-ethoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cccc(c1)Cl)nc1c2cccc1

STK546646
Synonyms: (8S,8aR,11aS)-10-(3,5-dichlorophenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@H]2[C@@H](C3N1C=Cc1c3cccc1)C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl

STK546648
Synonyms: N'-[(E)-furan-2-ylmethylidene]-3,4-dimethyl-2-thioxo-2,3-dihydro-1,3-thiazole-5-carbohydrazide
Smiles: O=C(c1sc(=S)n(c1C)C)N/N=C/c1ccco1

STK546649
Synonyms: ethyl4-{[10-methyl-8-phenyl-11-(thiophen-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccs2)c(nn1c1ccccc1)C

STK546650
Synonyms: [(4-fluorophenyl)sulfonyl][3-(4-{[(2-methylphenyl)carbonyl]amino}pyridinium-1-yl)quinoxalin-2-yl]azanide
Smiles: Fc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)NC(=O)c1ccccc1C

STK546651
Synonyms: N-(2-{(2Z)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)-2-fluorobenzamide(non-preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccccc2F)/c2c1cccc2

STK546652
Synonyms: N-{2-[(E)-2-(3-chlorophenyl)-1-cyanoethenyl]-4-phenyl-1,3-thiazol-5-yl}propanamide
Smiles: CCC(=O)Nc1sc(nc1c1ccccc1)/C(=C/c1cccc(c1)Cl)/C#N

STK546653
Synonyms: 5-[(2-methylphenyl)amino]-3-(4-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: O=C1SC(C(=O)N1Cc1ccc(cc1)[N+](=O)[O-])Nc1ccccc1C

STK546654
Synonyms: prop-2-en-1-yl2-amino-1-(3,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)OC)OC

STK546655
Synonyms: N'~1~-[(3E)-5-bromo-2-oxo-1-(propan-2-yl)-1,2-dihydro-3H-indol-3-ylidene]-N'~5~-[(3Z)-5-bromo-2-oxo-1-(propan-2-yl)-1,2-dihydro-3H-indol-3-ylidene]pentanedihydrazide
Smiles: CC(N1C(=O)/C(=N/NC(=O)CCCC(=O)N/N=C/2\C(=O)N(c3c2cc(Br)cc3)C(C)C)/c2c1ccc(c2)Br)C

STK546656
Synonyms: 4-(phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)-8-(3-fluorophenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)Oc1ccc(cc1)C(=O)c1ccccc1

STK546661
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[3-methoxy-4-(2-phenylethoxy)phenyl]methylidene}-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCCc1ccccc1

STK546663
Synonyms: 2-{[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nc(N)c(c(c1C#N)c1cccs1)C#N

STK546664
Synonyms: N-(diphenylmethyl)-2-{[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)NC(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546665
Synonyms: N-(1,4-dioxo-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}-1,4-dihydronaphthalen-2-yl)benzenesulfonamide
Smiles: O=C1C(=C(N2CCN(CC2)C/C=C/c2ccccc2)C(=O)c2c1cccc2)NS(=O)(=O)c1ccccc1

STK546667
Synonyms: ethyl4-[11-(2-methoxybenzyl)-4-oxo-4,11-dihydro-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-3-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1OC

STK546668
Synonyms: 1-methoxypropan-2-ylcyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
Smiles: COCC(OC(=O)C(c1nc2ccccc2nc1N1CCC(CC1)C)C#N)C

STK546669
Synonyms: (1'R,2'R)-2'-(4-bromophenyl)-1'-[(4-chlorophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)Br)C(=O)c1c(C2=O)cccc1

STK546670
Synonyms: ethyl5-(4-iodophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c1ccc(cc1)I

STK546671
Synonyms: methyl(2Z)-4-(furan-2-yl)-2-hydroxy-4-oxobut-2-enoate
Smiles: COC(=O)/C(=C/C(=O)c1ccco1)/O

STK546672
Synonyms: ethyl4-[(4-chlorophenyl)amino]-2-methylquinoline-6-carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)c(Nc1ccc(cc1)Cl)cc(n2)C

STK546673
Synonyms: (4Z)-4-(3-chloro-4-nitrobenzylidene)-2-(thiophen-2-yl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(c(c1)Cl)[N+](=O)[O-])c1cccs1

STK546674
Synonyms: N,N-dibutyl-2-{[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3)CCCC

STK546675
Synonyms: 4-butyl-7-[(3-methylbutyl)sulfanyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCc1nc2sc3c(c2c2c1CCC2)ncnc3SCCC(C)C

STK546676
Synonyms: 8-(2-methylprop-2-en-1-yl)-9-(propan-2-ylsulfanyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CC(=C)Cn1c(SC(C)C)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK546677
Synonyms: 1-methyl-4-(3-methylpiperidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxaline
Smiles: CC1CCCN(C1)c1nc2ccccc2n2c1nnc2C

STK546678
Synonyms: [(5-bromothiophen-2-yl)sulfonyl][3-(3,5-dimethylpyridinium-1-yl)quinoxalin-2-yl]azanide
Smiles: Cc1cc(C)c[n+](c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccc(s1)Br

STK546679
Synonyms: 9-[(3-methylbutyl)sulfanyl]-8-(3-methylphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CC(CCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCc1c3cccc1)C

STK546680
Synonyms: 2-(4-methoxyphenyl)-3-[2-(2,3,5-trimethylphenoxy)ethyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(C)cc(c1C)C

STK546682
Synonyms: ethyl4-cyano-5-({[(3-cyano-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-2-yl)sulfanyl]acetyl}amino)-3-methylthiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nc2CCCCCCc2cc1C#N

STK546683
Synonyms: (2'R,3'R)-2'-(4-bromophenyl)-3'-(phenylcarbonyl)-2',3'-dihydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-1,3-dione
Smiles: Brc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

STK546684
Synonyms: N-(diphenylmethyl)-2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)NC(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546685
Synonyms: ethyl6-amino-5-cyano-2-{[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]methyl}-4-(2-fluorophenyl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(CSc2nc3CCCc3cc2C#N)OC(=C(C1c1ccccc1F)C#N)N

STK546687
Synonyms: N-[1-(1H-benzimidazol-2-yl)butyl]-4-tert-butylbenzamide
Smiles: CCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccc(cc1)C(C)(C)C

STK546689
Synonyms: 2-methoxy-4-[(E)-{2-[(5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]hydrazinylidene}methyl]phenyl2-methyl-3-nitrobenzoate
Smiles: COc1cc(/C=N/NC(=O)Cn2nc(cc2C)[N+](=O)[O-])ccc1OC(=O)c1cccc(c1C)[N+](=O)[O-]

STK546692
Synonyms: 1-[4-(4-methylbenzyl)piperazin-1-yl]-3-(propan-2-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#Cc1c(cc(n2c1nc1c2cccc1)N1CCN(CC1)Cc1ccc(cc1)C)C(C)C

STK546693
Synonyms: 2-[(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-methyl-N-phenylacetamide
Smiles: CCc1nc(SCC(=O)N(c2ccccc2)C)c2c(n1)sc1c2CCCC1

STK546694
Synonyms: 1-methoxypropan-2-yl2-amino-1-[2-(cyclohex-1-en-1-yl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCC1=CCCCC1)C

STK546696
Synonyms: 2-amino-1-benzyl-N-(3,5-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1cc(cc(c1)C)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK546697
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-methoxyphenyl}methylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)cc(c1OCc1ccccc1Cl)Br

STK546698
Synonyms: 3-amino-N-(2,6-dimethylphenyl)-4-(4-fluorophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxamide
Smiles: Fc1ccc(cc1)c1cc(nc2c1c(N)c(s2)C(=O)Nc1c(C)cccc1C)c1ccccc1

STK546699
Synonyms: methylN-[(5-bromo-2-{[(2-chlorophenyl)carbonyl]amino}phenyl)(2-chlorophenyl)methyl]glycinate
Smiles: COC(=O)CNC(c1ccccc1Cl)c1cc(Br)ccc1NC(=O)c1ccccc1Cl

STK546700
Synonyms: 4-acetyl-1-butyl-3-hydroxy-5-(2-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCN1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)C)O

STK546702
Synonyms: 8-bromo-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole
Smiles: Brc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCCC1

STK546703
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)-3-phenoxypropanamide
Smiles: O=C(NCC1COc2c(O1)cccc2)CCOc1ccccc1

STK546704
Synonyms: 4-methyl-9,10-diphenyl-2,6-bis(tetrahydrofuran-2-ylmethyl)hexahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetrone
Smiles: O=C1N(CC2CCCO2)C(=O)C2C1C1C3C(=O)N(C(=O)C3C2(C(=C1c1ccccc1)c1ccccc1)C)CC1CCCO1

STK546705
Synonyms: 2-ethyl-5-{[4-(methoxycarbonyl)phenyl]amino}-5-oxopentanoicacid
Smiles: CCC(C(=O)O)CCC(=O)Nc1ccc(cc1)C(=O)OC

STK546706
Synonyms: methyl(1R,2S,3S)-3-[(4-chlorophenyl)carbamoyl]-1-cyano-2-(4-methoxyphenyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinoline-1-carboxylate
Smiles: COc1ccc(cc1)[C@@H]1[C@@H](C(=O)Nc2ccc(cc2)Cl)N2C([C@]1(C#N)C(=O)OC)c1ccccc1C=C2

STK546707
Synonyms: 5-(2-fluorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: C=CCN1C(=O)C(=C(C1c1ccccc1F)C(=O)c1ccccc1)O

STK546708
Synonyms: 4-{4-[(4-carboxyphenyl)amino]-2-(ethoxycarbonyl)-2-methyl-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzoicacid
Smiles: CCOC(=O)C1(C)C=C(C(=O)N1c1ccc(cc1)C(=O)O)Nc1ccc(cc1)C(=O)O

STK546709
Synonyms: 1-{1-(4-methoxyphenyl)-6-phenyl-8-[4-(propan-2-yl)phenyl]-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7,9-trien-3-yl}ethanone
Smiles: COc1ccc(cc1)N1N=C(SC21C=CC(=NN2c1ccccc1)c1ccc(cc1)C(C)C)C(=O)C

STK546710
Synonyms: (5E)-2-[4-(3-methylphenyl)piperazin-1-yl]-5-{4-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazol-4(5H)-one
Smiles: Cc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OCc2ccc(cc2)[N+](=O)[O-])/S1

STK546713
Synonyms: ethyl6,8-dichloro-4-[(3-hydroxyphenyl)amino]quinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1cccc(c1)O)cc(cc2Cl)Cl

STK546714
Synonyms: 10,10-dimethyl-2-phenyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(s2)ncn2c1nc(n2)c1ccccc1

STK546716
Synonyms: (6aS,6bR,9aS,10R)-10-[(3-bromo-4-methoxyphenyl)carbonyl]-8-(4-methylphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)C)C=Cc1c2cccc1

STK546717
Synonyms: prop-2-en-1-yl2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(c(c1)OC)OC

STK546718
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(benzyloxy)phenyl]methylidene}-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCCCC1)c1nonc1N)N/N=C/c1ccc(cc1)OCc1ccccc1

STK546719
Synonyms: N-(4-methylphenyl)-2,6-dioxo-3,11b-dihydro-2H,6H-chromeno[4',3':4,5]thiopyrano[2,3-d][1,3]thiazole-5-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)C1=C2C(=O)Oc3c(C2c2c(S1)[nH]c(=O)s2)cccc3

STK546720
Synonyms: ethyl4-({[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonyl]carbamothioyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=S)NC(=O)c1c(C)onc1c1ccccc1

STK546721
Synonyms: 2-(3-{2-[(3-nitrophenyl)carbonyl]hydrazinyl}-3-oxopropyl)hexanoicacid
Smiles: CCCCC(C(=O)O)CCC(=O)NNC(=O)c1cccc(c1)[N+](=O)[O-]

STK546722
Synonyms: 2-methoxy-N-[(5Z)-4-oxo-5-(pyridin-4-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: COc1ccccc1C(=O)NN1C(=S)S/C(=C\c2ccncc2)/C1=O

STK546723
Synonyms: 2-{[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-phenylacetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccccc2)nc(c(c1c1cccs1)C#N)N

STK546724
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylamino)methyl]-N'-[(E)-(2,4-dimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1OC)OC)CC

STK546725
Synonyms: 2-{4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-3-phenyl-1H-pyrazol-1-yl}acetamide
Smiles: NC(=O)Cn1cc(c(n1)c1ccccc1)/C=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N

STK546726
Synonyms: 1-benzyl-5-(2-fluorophenyl)-3-hydroxy-4-[(4-nitrophenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccccc1F)Cc1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK546727
Synonyms: methyl4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK546728
Synonyms: N,4-dibutyl-N-ethyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
Smiles: CCCCN(c1ncnc2c1sc1c2c2CCCc2c(n1)CCCC)CC

STK546729
Synonyms: 3-(4-bromophenyl)-2-[(E)-2-(4-chlorophenyl)ethenyl]-6-iodoquinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)/C=C/c1nc2ccc(cc2c(=O)n1c1ccc(cc1)Br)I

STK546730
Synonyms: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-bromophenyl)ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc(s1)N

STK546732
Synonyms: N-[3-(4-benzylpiperazin-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]thiophene-2-sulfonamide
Smiles: O=C1C(=C(N2CCN(CC2)Cc2ccccc2)C(=O)c2c1cccc2)NS(=O)(=O)c1cccs1

STK546733
Synonyms: 3-(biphenyl-4-yloxy)-8-[(dimethylamino)methyl]-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CN(Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc(cc1)c1ccccc1)C(F)(F)F)C

STK546734
Synonyms: 3-[3-(2,3-dimethylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cccc(c1C)C

STK546735
Synonyms: 3-(2,5-dimethoxyphenyl)-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: COc1ccc(c(c1)n1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O)OC

STK546736
Synonyms: [3-(4-tert-butylpyridinium-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl](thiophen-2-ylsulfonyl)azanide
Smiles: O=C1C(=C([N-]S(=O)(=O)c2cccs2)C(=O)c2c1cccc2)[n+]1ccc(cc1)C(C)(C)C

STK546737
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-[3-(trifluoromethyl)phenyl]-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)C(F)(F)F)cccc3

STK546740
Synonyms: 1-(3,5-dichlorophenyl)-3-(propylamino)pyrrolidine-2,5-dione
Smiles: CCCNC1CC(=O)N(C1=O)c1cc(Cl)cc(c1)Cl

STK546741
Synonyms: (2E)-N-(2-{(2Z)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)-3-(2-methoxyphenyl)prop-2-enamide(non-preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)/C=C/c2ccccc2OC)/c2c1cccc2

STK546743
Synonyms: (5E)-5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-1-ethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=S)NC(=O)/C(=C\Nc2c(=O)n(n(c2C)C)c2ccccc2)/C1=O

STK546744
Synonyms: 7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-3-(naphthalen-2-yloxy)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CN1CCN(CC1)Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F

STK546747
Synonyms: methyl2-imino-1-(4-methoxybenzyl)-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Smiles: COC(=O)c1cc2c(n(c1=N)Cc1ccc(cc1)OC)nc1n(c2=O)cccc1C

STK546748
Synonyms: 3-amino-7,7-dimethyl-7,8-dihydro-5H-thieno[2,3-b]thiopyrano[3,4-e]pyridine-2-carboxylicacid
Smiles: OC(=O)c1sc2c(c1N)cc1c(n2)CC(SC1)(C)C

STK546749
Synonyms: 5-({[4-(diethylamino)phenyl]amino}methylidene)-1,3-diphenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN(c1ccc(cc1)N/C=C/1\C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1)CC

STK546750
Synonyms: 4-[3-hydroxy-5-(4-methylphenyl)-2-oxo-4-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]butanoicacid
Smiles: OC(=O)CCCN1C(c2ccc(cc2)C)C(=C(C1=O)O)C(=O)c1ccccc1

STK546751
Synonyms: 3-(4-fluorophenyl)-1,5-diphenyl-4,5-dihydro-1H-pyrazole
Smiles: Fc1ccc(cc1)C1=NN(C(C1)c1ccccc1)c1ccccc1

STK546752
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-cyclohex-3-en-1-ylmethylidene]-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/C1CCC=CC1

STK546753
Synonyms: (3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(4-fluorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)F)C(=O)c1ccccc1

STK546754
Synonyms: (8S,8aR,11aS)-10-(2-methyl-4-nitrophenyl)-8-[(3-nitrophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Cc1cc(ccc1N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2)[N+](=O)[O-]

STK546755
Synonyms: propan-2-yl({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate
Smiles: CC(OC(=O)CSc1nnc(s1)SCc1cccc2c1cccc2)C

STK546756
Synonyms: prop-2-en-1-yl2-amino-1-(4-sulfamoylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)S(=O)(=O)N

STK546757
Synonyms: methyl2-amino-1-(3-methoxypropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCCn1c2nc3ccccc3nc2c(c1N)C(=O)OC

STK546758
Synonyms: 4-[3-acetyl-2-(2-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzoicacid
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccccc1F)c1ccc(cc1)C(=O)O

STK546759
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)OC)nnc1c1cccnc1

STK546760
Synonyms: (5E)-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)-1-(4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C\NCCCn2ccnc2)/C1=O

STK546761
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)c1nnn(c1C)c1nonc1N)OC

STK546762
Synonyms: 11-(3,5-dimethylphenyl)-3-(2-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccccc1n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cc(C)cc(c1)C

STK546763
Synonyms: ethyl5-methyl-3-(3-methylbutyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Smiles: CCOC(=O)c1sc2c(c1C)c(=O)n(cn2)CCC(C)C

STK546764
Synonyms: 2-[(4-amino-6,8-diphenyl-5,8-dihydro-6H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide
Smiles: CC(NC(=O)CSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1)CCc1ccccc1

STK546765
Synonyms: 2-methoxyethyl2-amino-1-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1

STK546766
Synonyms: 1-(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCC3(CC1)OCCO3)c(n2Cc1ccccc1)C

STK546767
Synonyms: N-{2-[(4,5-dimethyl-1,3-benzothiazol-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-3-phenylpropanamide
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)Nc1sc2c(n1)c(C)c(cc2)C)CCc1ccccc1

STK546769
Synonyms: 3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(diethylamino)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCN(c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)CC

STK546773
Synonyms: (1'R,2'R)-1'-[(4-methoxyphenyl)carbonyl]-2'-phenyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccccc1)C(=O)c1c(C2=O)cccc1

STK546774
Synonyms: 1-benzyl-4-(2-phenoxyethyl)piperazine
Smiles: c1ccc(cc1)OCCN1CCN(CC1)Cc1ccccc1

STK546775
Synonyms: 2-amino-1-(3-chloro-4-fluorophenyl)-N-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)F

STK546776
Synonyms: ethyl1-(3-{[(4-chlorophenyl)sulfonyl]amino}-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C1=C(NS(=O)(=O)c2ccc(cc2)Cl)C(=O)c2c(C1=O)cccc2

STK546777
Synonyms: N-(2,4-dimethylphenyl)-2-[(5-phenyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK546778
Synonyms: ethyl1-(4-bromophenyl)-8-(2,5-dimethylphenyl)-6-phenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7-diene-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)CCC(=NN2c1ccccc1)c1cc(C)ccc1C)c1ccc(cc1)Br

STK546779
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[3-bromo-5-ethoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylidene}-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)cc(c1OCc1cccc2c1cccc2)Br

STK546780
Synonyms: 3-amino-N-[2-(trifluoromethoxy)phenyl]-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)CCCC1)Nc1ccccc1OC(F)(F)F

STK546781
Synonyms: 3-ethyl6-methyl4-{[4-(benzyloxy)phenyl]amino}quinoline-3,6-dicarboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)OCc1ccccc1)cc(cc2)C(=O)OC

STK546782
Synonyms: 3-tert-butyl-7-{[2-(3-methylpiperidin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: CC1CCCN(C1)CCNc1cc2oc3cc(ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1)C(C)(C)C

STK546783
Synonyms: (2Z)-2-[3-chloro-5-(4-fluorophenyl)-2-(4-methylphenyl)-1-benzoxepin-4(5H)-ylidene]-N,N-dimethylethanamine
Smiles: CN(C/C=C/1\C(=C(Oc2c(C1c1ccc(cc1)F)cccc2)c1ccc(cc1)C)Cl)C

STK546784
Synonyms: 2-methyl-N'-{[(4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetyl}benzohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)[nH]1)NNC(=O)c1ccccc1C

STK546785
Synonyms: 3-[3-(2,4-dichloro-6-methylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)cc(cc1Cl)Cl

STK546786
Synonyms: 3-[(dimethylamino)methyl]-2,6,8-trimethylquinolin-4-ol
Smiles: CN(Cc1c(C)nc2c(c1O)cc(cc2C)C)C

STK546787
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(4-methylbenzyl)oxy]phenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK546788
Synonyms: ethyl4-{2-(4-fluorophenyl)-4-hydroxy-3-[(4-methoxyphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1ccc(cc1)F)C(=O)c1ccc(cc1)OC)O

STK546789
Synonyms: 3-[4-(2-tert-butyl-4-methylphenoxy)butyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccc(cc1C(C)(C)C)C

STK546790
Synonyms: 3-hydroxy-1-(4-hydroxyphenyl)-5-(4-nitrophenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Oc1ccc(cc1)N1C(c2ccc(cc2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccccc1

STK546791
Synonyms: N'~1~,N'~8~-bis[(3E)-1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]octanedihydrazide
Smiles: O=C(N/N=C/1\c2ccccc2N(C1=O)C)CCCCCCC(=O)N/N=C/1\c2ccccc2N(C1=O)C

STK546792
Synonyms: 1-(4-chlorophenyl)-2-[(6,6-dimethyl-2-phenyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]ethanone
Smiles: Clc1ccc(cc1)C(=O)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK546793
Synonyms: 5-{[3-(diethylamino)propyl]amino}-6-methyl-1,2,4-triazin-3(2H)-one
Smiles: CCN(CCCNc1nc(=O)[nH]nc1C)CC

STK546794
Synonyms: N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-3-methylbutan-1-amine
Smiles: CC(CCNCC1OCc2c(CO1)cccc2)C

STK546795
Synonyms: ethyl4-{[11-(2-fluorophenyl)-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(c1C2c1ccccc1F)C)c1ccccc1

STK546796
Synonyms: N,N-dibutyl-2-{[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3)CCCC

STK546797
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-butoxyphenyl)methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1C)c1nonc1N

STK546799
Synonyms: 3,4-difluoro-N-({2-[(2-phenylquinolin-4-yl)carbonyl]hydrazinyl}carbonothioyl)benzamide
Smiles: S=C(NC(=O)c1ccc(c(c1)F)F)NNC(=O)c1cc(nc2c1cccc2)c1ccccc1

STK546801
Synonyms: 7-{[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)ethyl]amino}-2-methyl-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: Cc1ccc2c(c1)[nH]c1c(o2)cc(c2c1c(=O)c1c(c2=O)cccc1)NCCN1CCC2(CC1)OCCO2

STK546802
Synonyms: 6-ethyl-2-methyl-3-{[methyl(1-methylpiperidin-4-yl)amino]methyl}quinolin-4-ol
Smiles: CCc1ccc2c(c1)c(O)c(c(n2)C)CN(C1CCN(CC1)C)C

STK546803
Synonyms: butyl2-amino-1-(3-chloro-4-fluorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)F

STK546804
Synonyms: N-(3-chloro-4-fluorophenyl)-10-methyl-8-phenyl-11-[4-(propan-2-yl)phenyl]-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CC(c1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)F)c1ccccc1)C

STK546805
Synonyms: 11-(4-tert-butylphenyl)-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(C2c2ccc(cc2)C(C)(C)C)c(nn1c1ccccc1)C

STK546807
Synonyms: 4-{3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-2-oxo-5-phenyl-2,5-dihydro-1H-pyrrol-1-yl}benzoicacid
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1)c1ccc(cc1)C(=O)O

STK546808
Synonyms: butyl2-amino-1-(4-hydroxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)O

STK546809
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(4-chlorobenzyl)oxy]phenyl}methylidene]-5-(morpholin-4-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/c1ccc(cc1)OCc1ccc(cc1)Cl

STK546810
Synonyms: 2,6-bis(hydroxymethyl)-4-methylphenyl4-methylbenzenesulfonate
Smiles: OCc1cc(C)cc(c1OS(=O)(=O)c1ccc(cc1)C)CO

STK546812
Synonyms: (6aS,6bR,9aS,10R)-10-[(4-bromophenyl)carbonyl]-3-chloro-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Brc1ccc(cc1)C(=O)[C@H]1[C@H]2C(=O)NC(=O)[C@H]2[C@H]2N1c1ccc(cc1C=C2)Cl

STK546813
Synonyms: 3-(3-bromophenyl)-5-(4-ethylphenyl)-3a,6a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(3H,5H)-tetrone
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)C1(OC2c2cccc(c2)Br)C(=O)c2c(C1=O)cccc2

STK546814
Synonyms: methyl(1R,2R,3S,3aS)-1-[(3-bromo-4-methoxyphenyl)carbonyl]-3-cyano-2-(furan-2-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H](c2ccco2)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccc(c(c1)Br)OC

STK546815
Synonyms: N-{[2-(phenylacetyl)hydrazinyl]carbonothioyl}pyridine-3-carboxamide
Smiles: S=C(NC(=O)c1cccnc1)NNC(=O)Cc1ccccc1

STK546816
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-bromo-4-fluorophenyl)methylidene]-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1ccc(c(c1)Br)F

STK546817
Synonyms: 1-[2-(diethylamino)ethyl]-3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-5-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCN(CCN1C(=O)C(=C(C1c1ccccc1)C(=O)c1ccc(cc1)OC)O)CC

STK546818
Synonyms: (3aR,4S,9aR,9bS)-2-(1,3-benzodioxol-5-yl)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCO2)C(=O)c1ccccc1

STK546820
Synonyms: 2-(2-fluorophenyl)-N-(2-phenylethyl)quinazolin-4-amine
Smiles: Fc1ccccc1c1nc(NCCc2ccccc2)c2c(n1)cccc2

STK546821
Synonyms: 3-[2-(4-tert-butyl-2-methylphenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1C)C(C)(C)C

STK546822
Synonyms: 2-[(E)-2-(4-bromophenyl)ethenyl]-3-(2,5-dibromophenyl)-6-iodoquinazolin-4(3H)-one
Smiles: Brc1ccc(c(c1)n1c(/C=C/c2ccc(cc2)Br)nc2c(c1=O)cc(cc2)I)Br

STK546823
Synonyms: methylN-[{5-bromo-2-[(phenylcarbonyl)amino]phenyl}(2-chlorophenyl)methyl]glycinate
Smiles: COC(=O)CNC(c1ccccc1Cl)c1cc(Br)ccc1NC(=O)c1ccccc1

STK546826
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(2-chlorobenzyl)oxy]phenyl}methylidene]-5-(phenoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1COc1ccccc1)C(=O)N/N=C/c1cccc(c1)OCc1ccccc1Cl

STK546827
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-chlorophenyl)carbonyl]-2-(3-nitrophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])C(=O)c1ccccc1

STK546828
Synonyms: 3-(2-methoxyphenyl)-11-[2-(4-methoxyphenyl)ethyl]-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccc(cc1)CCn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1ccccc1OC

STK546829
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(2-methoxy-5-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=Cc2c1cccc2)[N+](=O)[O-]

STK546830
Synonyms: 7-(4-methoxyphenyl)-9-(4-nitrophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazoline
Smiles: COc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)[N+](=O)[O-])c1c(CC2)cccc1

STK546831
Synonyms: (5Z)-3-(1,3-benzodioxol-5-yl)-5-[4-(octyloxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1ccc2c(c1)OCO2

STK546833
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylamino)methyl]-N'-[(E)-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(c(c1)COc1ccc(c(c1)C)[N+](=O)[O-])OC)CC

STK546834
Synonyms: N-(2,4-dimethylphenyl)-11-(4-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Fc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1C)C)c1ccccc1

STK546835
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(4-methylphenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=Cc2c1cccc2

STK546836
Synonyms: (2-methoxy-5-{[4-(4-methylphenyl)phthalazin-1-yl]amino}phenyl)(piperidin-1-yl)methanone
Smiles: COc1ccc(cc1C(=O)N1CCCCC1)Nc1nnc(c2c1cccc2)c1ccc(cc1)C

STK546837
Synonyms: N-({4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}carbamothioyl)-3,4-difluorobenzamide
Smiles: COc1nc(OC)nc(c1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)c1ccc(c(c1)F)F

STK546839
Synonyms: N-{1-(3-butoxypropyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}-4-chlorobenzenesulfonamide
Smiles: CCCCOCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)Cl)S(=O)(=O)c1ccc(cc1)C

STK546840
Synonyms: 2-[4-(benzyloxy)-3-methoxyphenyl]-5-(biphenyl-4-yl)-4-phenyl-1H-imidazole
Smiles: COc1cc(ccc1OCc1ccccc1)c1[nH]c(c(n1)c1ccccc1)c1ccc(cc1)c1ccccc1

STK546841
Synonyms: 2-(4-methoxyphenyl)-3-[3-(4-methyl-2-nitrophenoxy)propyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1[N+](=O)[O-])C

STK546842
Synonyms: 2-[(3,4-dichlorobenzyl)sulfanyl]-5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazole
Smiles: Clc1ccc(cc1Cl)CSc1nnc(s1)SCc1cccc2c1cccc2

STK546843
Synonyms: ethyl5-methyl-3-{[(2,4,5-trimethylphenyl)carbonyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1cc(C)c(cc1C)C)cc(cc2)C

STK546844
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-methoxy-3-[(2,4,6-trichlorophenoxy)methyl]phenyl}methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1COc1c(Cl)cc(cc1Cl)Cl)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK546845
Synonyms: 2-methoxyethyl2-amino-1-(3,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)OC)OC

STK546846
Synonyms: N-[1-(1-benzyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-3-methylbutanamide
Smiles: CSCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)CC(C)C

STK546847
Synonyms: 2-amino-1-(3-chloro-4-methoxyphenyl)-N-phenyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(cc1Cl)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1ccccc1

STK546848
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[3-(1H-benzotriazol-1-ylmethyl)-4-methoxyphenyl]methylidene}-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1Cn1nnc2c1cccc2)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK546849
Synonyms: 3-butyl-2-(propan-2-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCn1c(SC(C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546851
Synonyms: 11-(3,5-dichlorophenyl)-3-(3,5-dimethylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1cc(C)cc(c1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cc(Cl)cc(c1)Cl

STK546852
Synonyms: 2-[(5Z)-5-(2,4-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanedioicacid
Smiles: COc1cc(OC)ccc1/C=C/1\SC(=S)N(C1=O)C(C(=O)O)CCC(=O)O

STK546853
Synonyms: 3-bromo-N-(3,5-dichlorophenyl)-2-oxo-2H-pyran-5-carboxamide
Smiles: Clc1cc(cc(c1)Cl)NC(=O)c1coc(=O)c(c1)Br

STK546854
Synonyms: prop-2-en-1-yl2-amino-1-(3,5-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK546855
Synonyms: propan-2-yl2-amino-1-[2-(4-sulfamoylphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(cc1)S(=O)(=O)N)C

STK546856
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(1E)-1-[4-(benzyloxy)phenyl]ethylidene}-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1C)c1nonc1N)/c1ccc(cc1)OCc1ccccc1

STK546857
Synonyms: (3aR,4S,9aR,9bS)-2-(2-chlorophenyl)-4-[(4-chlorophenyl)carbonyl]-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Cl)C(=O)c1ccccc1

STK546858
Synonyms: N-(3-cyano-1-phenyl-1H-pyrrolo[2,3-b]quinoxalin-2-yl)-4-methylbenzenesulfonamide
Smiles: N#Cc1c(NS(=O)(=O)c2ccc(cc2)C)n(c2c1nc1ccccc1n2)c1ccccc1

STK546860
Synonyms: 7-(4-chlorophenyl)-N,N-diethyl-7H-chromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-3-amine
Smiles: CCN(c1ccc2c(c1)OC1=NC(n3c(C1=C2)nc1c3cccc1)c1ccc(cc1)Cl)CC

STK546861
Synonyms: 2-propyl-5-(thiophen-2-yl)-4H-thieno[2,3-d][1,3]oxazin-4-one
Smiles: CCCc1oc(=O)c2c(n1)scc2c1cccs1

STK546862
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nnc1c1cccnc1

STK546863
Synonyms: N-(3-methylphenyl)-2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546864
Synonyms: N-(4-bromophenyl)-2-{[4-(4-bromophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK546865
Synonyms: 3-(4-chlorophenyl)-3-[4-hydroxy-2-methyl-5-(propan-2-yl)phenyl]-2-benzofuran-1(3H)-one
Smiles: Clc1ccc(cc1)C1(OC(=O)c2c1cccc2)c1cc(C(C)C)c(cc1C)O

STK546866
Synonyms: N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-4-fluorobenzamide
Smiles: NC(=N)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)F

STK546867
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{2-[(2,6-dichlorobenzyl)oxy]-5-nitrophenyl}methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1C)c1nonc1N)N/N=C/c1cc(ccc1OCc1c(Cl)cccc1Cl)[N+](=O)[O-]

STK546868
Synonyms: 7-tert-butyl-2-(butylsulfanyl)-3-(3-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCC(C3)C(C)(C)C

STK546869
Synonyms: 3-amino-N-(2-chlorobenzyl)-6-ethyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)NCc1ccccc1Cl

STK546870
Synonyms: N-(4-methoxyphenyl)-2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2ccc(cc2)OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546871
Synonyms: N-{3-[(4-methylphenyl)sulfonyl]-1-(tetrahydrofuran-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NS(=O)(=O)c2ccccc2)n(c2c1nc1ccccc1n2)CC1CCCO1

STK546872
Synonyms: 2-cyano-2-[3-(3,5-dimethylpiperidin-1-yl)quinoxalin-2-yl]-N-(1-phenylethyl)acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CC(C)CC(C1)C)C(=O)NC(c1ccccc1)C

STK546873
Synonyms: 4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-N'-[(E)-phenylmethylidene]benzohydrazide
Smiles: O=C(c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1ccccc1

STK546874
Synonyms: prop-2-en-1-yl2-amino-1-(3,4-dichlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)Cl

STK546875
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylamino)methyl]-N'-{(1E)-1-[4-(2-methylpropyl)phenyl]ethylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)CC(C)C)\C)CC

STK546876
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dimethoxyphenyl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK546877
Synonyms: 2-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-4H-[1,3]oxathiolo[4,5-c]chromen-4-one
Smiles: O=c1oc2ccccc2c2c1SC(=C(C(F)(F)F)C(F)(F)F)O2

STK546878
Synonyms: 5-{4-[(3-bromophenyl)amino]phthalazin-1-yl}-2-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide
Smiles: Brc1cccc(c1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NCc1cccnc1)C

STK546879
Synonyms: 1-(4-acetylphenyl)-3-(2-methoxydibenzo[b,d]furan-3-yl)thiourea
Smiles: COc1cc2c(cc1NC(=S)Nc1ccc(cc1)C(=O)C)oc1c2cccc1

STK546881
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)N(C)C)C

STK546882
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-3-fluoro-N-[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]benzamide
Smiles: Fc1cccc(c1)C(=O)N(C1CC(=O)N(C1=O)c1ccc(cc1)F)Cc1ccc2c(c1)OCO2

STK546883
Synonyms: 11-[4-(dimethylamino)phenyl]-10-methyl-N-(4-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)N(C)C)C)c1ccccc1

STK546884
Synonyms: 3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1-(4-methoxyphenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)N1C(=O)C(=C(C1c1ccc(c(c1)OC)O)C(=O)c1ccccc1)O

STK546885
Synonyms: 2-(4-ethylpiperazin-1-yl)-3-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)CC)/C1=O

STK546886
Synonyms: {3-[4-(3-chlorophenyl)piperazin-1-yl]quinoxalin-2-yl}[(4-methylphenyl)sulfonyl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1)Cl

STK546887
Synonyms: (5E)-5-(carbamoylimino)-3-(1-phenylpropan-2-yl)-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Smiles: CC([N+]1=NO/C(=N/C(=O)N)/[CH-]1)Cc1ccccc1

STK546891
Synonyms: 6-iodo-3-(naphthalen-1-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-])c1cccc2c1cccc2

STK546892
Synonyms: (2E)-2-cyano-N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-[4-(propan-2-yl)phenyl]prop-2-enamide
Smiles: CCOc1ccc(cc1)c1csc(n1)NC(=O)/C(=C/c1ccc(cc1)C(C)C)/C#N

STK546893
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(2,4-dichlorobenzyl)oxy]phenyl}methylidene]-5-(phenoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(c(c1)Cl)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1COc1ccccc1)c1nonc1N

STK546894
Synonyms: 5-(3-fluorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: C=CCN1C(=O)C(=C(C1c1cccc(c1)F)C(=O)c1ccccc1)O

STK546895
Synonyms: N-(3-chloro-4-fluorophenyl)-11-(4-chlorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Clc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)F)c1ccccc1

STK546896
Synonyms: [(4-bromophenyl)sulfonyl][1,4-dioxo-3-(pyridinium-1-yl)-1,4-dihydronaphthalen-2-yl]azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccccc2)C(=O)c2c(C1=O)cccc2

STK546897
Synonyms: 4-(2,6-dimethylmorpholin-4-yl)-8-methyl-5H-pyrimido[5,4-b]indole
Smiles: CC1OC(C)CN(C1)c1ncnc2c1[nH]c1c2cc(cc1)C

STK546898
Synonyms: 6-hydroxy-3-(2-methylphenyl)-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: Cc1ccccc1n1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK546899
Synonyms: 2-(4-ethoxy-3-methoxyphenyl)-10-iminotetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile
Smiles: CCOc1ccc(cc1OC)C1OC23CCCCC3C(C1(C#N)C(=N)O2)(C#N)C#N

STK546900
Synonyms: 1-(benzyloxy)-3-(4-methylphenyl)quinoxalin-2(1H)-one4-oxide
Smiles: Cc1ccc(cc1)c1c(=O)n(OCc2ccccc2)c2c([n+]1[O-])cccc2

STK546901
Synonyms: (3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(4-methylphenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)C)C(=O)c1ccccc1

STK546902
Synonyms: ethyl5-bromo-3-({[3-(trifluoromethyl)phenyl]carbonyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1cccc(c1)C(F)(F)F)cc(cc2)Br

STK546904
Synonyms: (6aS,6bR,9aS,10R)-10-(1H-benzotriazol-1-ylcarbonyl)-8-(4-bromophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Brc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)n1nnc2c1cccc2

STK546905
Synonyms: 2-(hexylsulfanyl)-6-iodo-3-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: CCCCCCSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)OC)I

STK546907
Synonyms: 6-hydroxy-3-(prop-2-en-1-yl)-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: C=CCn1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK546909
Synonyms: 2-(4-nitrophenyl)butanedioicacid
Smiles: OC(=O)CC(c1ccc(cc1)[N+](=O)[O-])C(=O)O

STK546911
Synonyms: 1-methyl-7-{[2-(2-methylpiperidin-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: CC1CCCCN1CCNc1cc2oc3cccc(c3[nH]c2c2c1c(=O)c1ccccc1c2=O)C

STK546912
Synonyms: 11-(3-methoxyphenyl)-3-(4-methoxyphenyl)-10-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccc(c1)OC)C(=O)c1ccccc1

STK546913
Synonyms: 4-methyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]phthalazin-1(2H)-one
Smiles: CN1CCN(CC1)C(=O)Cn1nc(C)c2c(c1=O)cccc2

STK546914
Synonyms: 2-[3-(4-benzylpiperazin-1-yl)quinoxalin-2-yl]-2-cyano-N-[2-(4-methoxyphenyl)ethyl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)C(=O)NCCc1ccc(cc1)OC

STK546915
Synonyms: 2-methoxyethyl2-amino-1-pentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OCCOC

STK546918
Synonyms: 2-amino-1-(2-chlorobenzyl)-N-(tetrahydrofuran-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1Cl)NCC1CCCO1

STK546919
Synonyms: 3-(methylsulfanyl)-5-phenyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1

STK546920
Synonyms: 3-amino-N-(2,5-dichlorophenyl)-6-ethyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)Nc1cc(Cl)ccc1Cl

STK546921
Synonyms: N-(3-fluoro-4-methylphenyl)-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)C)nc2c(c1=O)cccc2

STK546922
Synonyms: 3-(1-benzyl-1H-indol-3-yl)-1-(naphthalen-2-yl)pyrrolidine-2,5-dione
Smiles: O=C1CC(C(=O)N1c1ccc2c(c1)cccc2)c1cn(c2c1cccc2)Cc1ccccc1

STK546924
Synonyms: 3-bromo-N-(2-{(2Z)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2cccc(c2)Br)/c2c1cccc2

STK546925
Synonyms: 2-amino-1-(3,5-dimethylphenyl)-N-(3-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK546927
Synonyms: ethyl2-({[(3,4-difluorophenyl)carbonyl]carbamothioyl}amino)-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(c(c2)F)F)[nH]c2c1CCCCC2

STK546928
Synonyms: 2-amino-1-(4-chloro-3-nitrophenyl)-N-cyclohexyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)[N+](=O)[O-])Cl)NC1CCCCC1

STK546929
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-5-methoxy-4-[(3-methylbenzyl)oxy]phenyl}methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)cc(c1OCc1cccc(c1)C)Br

STK546930
Synonyms: N-[4-(acetylamino)phenyl]-2-{[4-(4-bromophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK546932
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-ethoxyphenyl}methylidene]-5-(phenoxymethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)cc(c1OCc1ccccc1Cl)Br

STK546933
Synonyms: ethyl2-[(2,4-dichlorophenyl)amino]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)Nc1ccc(cc1Cl)Cl

STK546936
Synonyms: 11-[4-(dimethylamino)phenyl]-N-(2,5-dimethylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1ccc(c(c1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)N(C)C)c(nn1c1ccccc1)C)C

STK546938
Synonyms: 3-[2-(4-bromo-2,6-dimethylphenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1c(C)cc(cc1C)Br

STK546939
Synonyms: methyl2-({[(3,4,5-trimethoxyphenyl)carbonyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)c2cc(OC)c(c(c2)OC)OC)sc2c1CCCCCC2

STK546940
Synonyms: 5-methyl-2-(propan-2-yl)cyclohexyl[4-(dimethylamino)phenyl][(4-methylphenyl)(phenylamino)methyl]phosphinate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1)C)Nc1ccccc1)c1ccc(cc1)N(C)C)C(C)C

STK546941
Synonyms: 3-[2-(2-tert-butyl-4-methylphenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1C(C)(C)C)C

STK546942
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546943
Synonyms: N'-{(E)-[1-(4-ethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}benzohydrazide
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C\NNC(=O)c2ccccc2)/C1=O

STK546944
Synonyms: 2-ethyl-4-[(4-methoxybenzyl)sulfanyl]-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCc1nc(SCc2ccc(cc2)OC)c2c(n1)sc1c2CC(OC1)(C)C

STK546946
Synonyms: 5-(2-acetyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-3-phenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: CC(=O)N1CCc2c(C1c1c(O)[nH]c(=S)n(c1=O)c1ccccc1)cccc2

STK546947
Synonyms: 4-amino-N'-[(E)-(2-chloro-6-fluorophenyl)methylidene]-1,2,5-oxadiazole-3-carbohydrazonamide
Smiles: Fc1cccc(c1/C=N/N=C(/c1nonc1N)\N)Cl

STK546949
Synonyms: 4-(phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)-8-(2-fluorophenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: O=C([C@@H]1N2c3ccccc3C=C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1F)Oc1ccc(cc1)C(=O)c1ccccc1

STK546950
Synonyms: N-[1-(1-benzyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]thiophene-2-carboxamide
Smiles: CSCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)c1cccs1

STK546951
Synonyms: 2-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylamino)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-6-methoxyphenylbenzoate
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1OC(=O)c1ccccc1)OC)CC

STK546952
Synonyms: 3-methylbenzylN'-cyano-N-(2-fluorophenyl)carbamimidothioate
Smiles: N#C/N=C(/Nc1ccccc1F)\SCc1cccc(c1)C

STK546953
Synonyms: 4-amino-N'-[(E)-pyridin-2-ylmethylidene]-1,2,5-oxadiazole-3-carbohydrazonamide
Smiles: N/C(=N\N=C\c1ccccn1)/c1nonc1N

STK546954
Synonyms: N,N-dibutyl-2-[(2-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCCCN(C(=O)CSc1nc(nc2c1c1CCCCc1s2)c1ccccc1)CCCC

STK546956
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-5-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}methylidene]-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCc3c2cccc3)c2nonc2N)cc(c1OCc1ccc(cc1)F)Br

STK546957
Synonyms: methyl2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)OC

STK546958
Synonyms: 11-(3-bromophenyl)-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(C2c2cccc(c2)Br)c(nn1c1ccccc1)C

STK546959
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-bromophenyl)methylidene]-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)Br

STK546960
Synonyms: {3-[1-(3-{[(4-methoxyphenyl)carbonyl]amino}propyl)-1H-imidazol-3-ium-3-yl]-1,4-dioxo-1,4-dihydronaphthalen-2-yl}(phenylsulfonyl)azanide
Smiles: COc1ccc(cc1)C(=O)NCCCn1cc[n+](c1)C1=C([N-]S(=O)(=O)c2ccccc2)C(=O)c2c(C1=O)cccc2

STK546961
Synonyms: ethyl4-{[11-(4-tert-butylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)(C)C)c(nn1c1ccccc1)C

STK546962
Synonyms: 3-[(4-chlorophenyl)sulfonyl]-1-cyclohexyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: Clc1ccc(cc1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)C1CCCCC1

STK546963
Synonyms: 2-methoxyethylcyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate
Smiles: COCCOC(=O)C(c1nc2ccccc2nc1N1CCCCC1)C#N

STK546964
Synonyms: N-(4-bromophenyl)-2-[(5-phenyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK546965
Synonyms: (6aS,6bR,9aS,10R)-10-[(3-bromo-4-methoxyphenyl)carbonyl]-8-(3-chlorophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc(c1)Cl)C=Cc1c2cccc1

STK546966
Synonyms: N-(2,4-dimethylphenyl)-2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2ccc(cc2C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546967
Synonyms: 8-chloro-4-(2,6-dimethylmorpholin-4-yl)-5H-pyrimido[5,4-b]indole
Smiles: CC1OC(C)CN(C1)c1ncnc2c1[nH]c1c2cc(cc1)Cl

STK546968
Synonyms: 4-acetyl-3-hydroxy-1-(4-hydroxyphenyl)-5-(3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cccc(c1)C1C(=C(C(=O)N1c1ccc(cc1)O)O)C(=O)C

STK546969
Synonyms: 1-[1-(3-chlorophenyl)-8-(4-ethylphenyl)-6-phenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7-dien-3-yl]ethanone
Smiles: CCc1ccc(cc1)C1=NN(C2(CC1)SC(=NN2c1cccc(c1)Cl)C(=O)C)c1ccccc1

STK546971
Synonyms: 2-(4-ethylphenyl)-9-phenyltetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)N1N(C2c2ccccc2)CCC1

STK546972
Synonyms: propan-2-yl2-amino-1-(4-chlorobenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)Cl)C

STK546973
Synonyms: 1-benzyl-2-imino-N-(2-methoxyethyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: COCCNC(=O)c1cc2c(n(c1=N)Cc1ccccc1)nc1n(c2=O)cccc1

STK546974
Synonyms: N-[4-(4,4-dimethyl-3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)benzyl]-1-ethyl-1H-benzimidazol-2-amine
Smiles: CCn1c(NCc2ccc(cc2)N2N=C(C(C2c2ccccc2)(C)C)c2ccccc2)nc2c1cccc2

STK546976
Synonyms: N-[2-(2-amino-3-cyano-1H-pyrrolo[2,3-b]quinoxalin-1-yl)ethyl]-4-methylbenzenesulfonamide
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)CCNS(=O)(=O)c1ccc(cc1)C

STK546977
Synonyms: 4-{6-[(3-chlorophenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzene-1,2-diol
Smiles: Clc1cccc(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(c(c1)O)O)C)c1ccccc1

STK546978
Synonyms: (phenylsulfonyl)(3-{3-[(thiophen-2-ylcarbonyl)amino]pyridinium-1-yl}quinoxalin-2-yl)azanide
Smiles: O=C(c1cccs1)Nc1ccc[n+](c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1

STK546979
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-{[3-cyano-6-methyl-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nc(cc1c1cccs1)C

STK546980
Synonyms: (4Z)-2-(3-nitrophenyl)-4-(4-propoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: CCCOc1ccc(cc1)/C=C/1\N=C(OC1=O)c1cccc(c1)[N+](=O)[O-]

STK546982
Synonyms: (5Z)-3-(4-bromophenyl)-5-[4-(octyloxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)Br

STK546984
Synonyms: N-(2-{(2Z)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)-2-(4-methoxyphenyl)acetamide(non-preferredname)
Smiles: N#CCCCN1c2ccccc2/C(=N/NC(=O)CNC(=O)Cc2ccc(cc2)OC)/C1=O

STK546985
Synonyms: 11-(4-tert-butylphenyl)-3-(4-methoxyphenyl)-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccc(cc1)C(C)(C)C)C(=O)Cc1ccccc1

STK546986
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-bromo-4-[(3-chlorobenzyl)oxy]-5-methoxyphenyl}methylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)cc(c1OCc1cccc(c1)Cl)Br

STK546987
Synonyms: [(4-bromophenyl)sulfonyl][3-(1-ethenyl-1H-imidazol-3-ium-3-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]azanide
Smiles: C=Cn1cc[n+](c1)C1=C([N-]S(=O)(=O)c2ccc(cc2)Br)C(=O)c2c(C1=O)cccc2

STK546988
Synonyms: N'-[(E)-1H-indol-3-ylmethylidene]-2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccccc1)N/N=C/c1c[nH]c2c1cccc2

STK546989
Synonyms: bis[5-methyl-2-(propan-2-yl)cyclohexyl][hydroxy(4-methylphenyl)methyl]phosphonate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1)C)O)OC1CC(C)CCC1C(C)C)C(C)C

STK546991
Synonyms: 11-(3-chlorophenyl)-N-(2,5-dimethylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Clc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cc(C)ccc1C)c1ccccc1

STK546992
Synonyms: 2-amino-1-(4-chlorophenyl)-N-(3,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Cl

STK546995
Synonyms: 2-cyano-2-{3-[4-(3,4-dimethoxybenzyl)piperazin-1-yl]quinoxalin-2-yl}-N-(2-phenylethyl)acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc(c(c1)OC)OC)C(=O)NCCc1ccccc1

STK546996
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-bromophenyl)ethylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)Br)\C

STK546997
Synonyms: 2-[(4-amino-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-benzylacetamide
Smiles: CC1CCc2c(C1)sc1c2c(N)nc(n1)SCC(=O)NCc1ccccc1

STK546998
Synonyms: 4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2,6-dimethoxyphenylbenzoate
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1OC(=O)c1ccccc1)OC

STK546999
Synonyms: prop-2-en-1-yl2-amino-1-(3,5-dichlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(Cl)cc(c1)Cl

STK547001
Synonyms: 4-(butylsulfanyl)-2-ethyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCCCSc1nc(CC)nc2c1c1CC(C)(C)OCc1s2

STK547003
Synonyms: 8-chloro-4-(3,5-dimethylpiperidin-1-yl)-5H-pyrimido[5,4-b]indole
Smiles: CC1CC(C)CN(C1)c1ncnc2c1[nH]c1c2cc(cc1)Cl

STK547005
Synonyms: 5-(biphenyl-4-yl)-2-(3-bromo-4-methoxyphenyl)-4-phenyl-1H-imidazole
Smiles: COc1ccc(cc1Br)c1nc(c([nH]1)c1ccc(cc1)c1ccccc1)c1ccccc1

STK547006
Synonyms: (3aS,6R)-2-(2-fluorophenyl)-3-(2-methylprop-2-en-1-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylicacid
Smiles: CC(=C)CC1N(C(=O)C2[C@]31C=C[C@H](O3)C2C(=O)O)c1ccccc1F

STK547007
Synonyms: ethylN-(6-chloro-1,3-benzothiazol-2-yl)-3,3,3-trifluoro-2-(pentanoylamino)alaninate
Smiles: CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1nc2c(s1)cc(cc2)Cl

STK547008
Synonyms: 3-(4-bromophenyl)-5-(2-methoxyphenyl)-1-phenyl-4,5-dihydro-1H-pyrazole
Smiles: COc1ccccc1C1CC(=NN1c1ccccc1)c1ccc(cc1)Br

STK547009
Synonyms: 1-methoxypropan-2-yl[3-(4-benzylpiperazin-1-yl)quinoxalin-2-yl](cyano)acetate
Smiles: COCC(OC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)C#N)C

STK547011
Synonyms: methyl5-chloro-3-[(3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propanoyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)Cl

STK547012
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-[(E)-{3-[(4-methylbenzyl)oxy]phenyl}methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)COc1cccc(c1)/C=N/NC(=O)c1nnn(c1C)c1nonc1N

STK547013
Synonyms: methyl3-{[(2E)-3-phenylprop-2-enoyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)/C=C/c1ccccc1)cccc2

STK547014
Synonyms: 5-{[4-(ethoxycarbonyl)phenyl]amino}-2-ethyl-5-oxopentanoicacid
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CCC(C(=O)O)CC

STK547016
Synonyms: 11-(4-tert-butylphenyl)-N-(3,5-dimethylphenyl)-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(C2c2ccc(cc2)C(C)(C)C)c(nn1c1ccccc1)C

STK547017
Synonyms: 3-(benzylsulfanyl)-5-phenyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: c1ccc(cc1)CSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK547019
Synonyms: 11-benzyl-3-(2-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccccc1n1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1

STK547020
Synonyms: 2-amino-7,9-dimethyl-5-oxo-4-phenyl-5,6-dihydro-4H-pyrano[2,3-d]thieno[3,2-b:5,4-b']dipyridine-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1)c(=O)[nH]c1c2sc2c1c(C)cc(n2)C

STK547021
Synonyms: 1-[(3-methoxyphenyl)amino]-3-methyl-2-(3-methylbutyl)pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: COc1cccc(c1)Nc1c(CCC(C)C)c(C)c(c2n1c1ccccc1n2)C#N

STK547022
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(piperidin-1-ylmethyl)-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc(c1OC)OC

STK547023
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylidene}-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc1OCc1cccc2c1cccc2

STK547024
Synonyms: ethyl4-[({2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxalin-3-yl}carbonyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(c(c1)OC)OC

STK547025
Synonyms: 2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(s1)SCc1ccccc1

STK547026
Synonyms: ethyl2-[({[5-(3-chloro-1-benzothiophen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(o2)c2sc3c(c2Cl)cccc3)sc2c1CCCC2

STK547027
Synonyms: 3-[(tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoicacid
Smiles: COc1ccc(cc1)C(NC(=O)OC(C)(C)C)CC(=O)O

STK547028
Synonyms: methyl5-chloro-3-{[(2-nitrophenyl)carbonyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccccc1[N+](=O)[O-])cc(cc2)Cl

STK547029
Synonyms: 2,2-dimethyl-5-(morpholin-4-yl)-8-{[(2E)-5-phenylhex-2-en-1-yl]sulfanyl}-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC(c1ccccc1)C/C=C/CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK547030
Synonyms: 6-chloro-3-[5-(4-ethylphenyl)-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenylquinolin-2(1H)-one
Smiles: CCc1ccc(cc1)C1CC(=NN1S(=O)(=O)C)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

STK547031
Synonyms: 3-(3,5-dimethylphenyl)-11-(4-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccc(cc1)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK547032
Synonyms: ethyl4-hydroxy-2-(4-methoxyphenyl)-1-(4-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)OC)c1ccc(cc1)[N+](=O)[O-]

STK547033
Synonyms: 4-(6-amino-5-cyano-3-methyl-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenylacetate
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)OC(=O)C)c(C)nn2c1ccccc1

STK547034
Synonyms: 2-(hexylsulfanyl)-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCn1c(SCCCCCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547035
Synonyms: 3-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylamino)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}phenyl3-methyl-4-nitrobenzoate
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)OC(=O)c1ccc(c(c1)C)[N+](=O)[O-])CC

STK547036
Synonyms: [(1S,2R,3S)-2-(4-methoxyphenyl)-1-nitro-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazin-3-yl](phenyl)methanone
Smiles: COc1ccc(cc1)[C@H]1[C@H]([N+](=O)[O-])C2N([C@@H]1C(=O)c1ccccc1)N=Cc1c2cccc1

STK547037
Synonyms: ethyl4-[(10-methyl-8,11-diphenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-yl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2)c(nn1c1ccccc1)C

STK547039
Synonyms: 8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-3-(naphthalen-2-yloxy)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CCC1CCCCN1Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F

STK547040
Synonyms: (3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(naphthalen-2-yl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)cccc2)C(=O)c1ccccc1

STK547041
Synonyms: N'-[(E)-(2-hydroxyphenyl)methylidene]-4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzohydrazide
Smiles: O=C(c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1ccccc1O

STK547042
Synonyms: 2-amino-N-cyclohexyl-1-(9-ethyl-9H-carbazol-3-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCn1c2ccc(cc2c2c1cccc2)n1c2nc3ccccc3nc2c(c1N)C(=O)NC1CCCCC1

STK547043
Synonyms: naphthalen-1-yl{4-(4-nitrophenyl)-2-[(2,4,6-trimethylbenzyl)sulfanyl]-1H-imidazol-1-yl}methanone
Smiles: Cc1cc(C)c(c(c1)C)CSc1nc(cn1C(=O)c1cccc2c1cccc2)c1ccc(cc1)[N+](=O)[O-]

STK547044
Synonyms: N-[5-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1-phenyl-1H-1,2,4-triazol-3-yl]-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1nc(n(n1)c1ccccc1)N1C(=O)c2c(C1=O)cccc2

STK547045
Synonyms: N-(4-bromo-2-{[(2-hydrazinyl-2-oxoethyl)amino](phenyl)methyl}phenyl)-3-chlorobenzamide(non-preferredname)
Smiles: NNC(=O)CNC(c1cc(Br)ccc1NC(=O)c1cccc(c1)Cl)c1ccccc1

STK547047
Synonyms: 3-[3-(2-chlorophenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccccc1Cl

STK547048
Synonyms: 4-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-ethoxyphenol
Smiles: CCOc1cc(ccc1O)c1[nH]c(c(n1)c1ccc(cc1)Cl)c1ccc(cc1)Cl

STK547049
Synonyms: 4-(1H-benzimidazol-2-ylsulfanyl)-2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: c1ccc(cc1)Cc1nc(Sc2nc3c([nH]2)cccc3)c2c(n1)sc1c2CCCC1

STK547051
Synonyms: 2-{[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl}-N-(4-bromo-2-methylphenyl)acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1ccc(cc1C)Br)c1ccc2c(c1)OCO2

STK547053
Synonyms: 2-(4-chlorophenyl)-3-(4-{2-methoxy-4-[(1E)-prop-1-en-1-yl]phenoxy}butyl)quinazolin-4(3H)-one
Smiles: C/C=C/c1ccc(c(c1)OC)OCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK547054
Synonyms: 4-{[6-bromo-3-(ethoxycarbonyl)quinolin-4-yl]amino}benzoicacid
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)C(=O)O)cc(cc2)Br

STK547055
Synonyms: 7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-3-(naphthalen-2-yloxy)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CC1CCCCN1Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F

STK547056
Synonyms: N-[4-(acetylamino)phenyl]-2-{[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

STK547059
Synonyms: methyl5-bromo-3-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])cc(cc2)Br

STK547061
Synonyms: (2E)-4-oxo-4-[2-(propan-2-yl)-1H-benzimidazol-1-yl]but-2-enoicacid
Smiles: OC(=O)/C=C/C(=O)n1c(nc2c1cccc2)C(C)C

STK547062
Synonyms: 2-[(3-bromobenzyl)sulfanyl]-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile
Smiles: N#Cc1cc2CN(C)CCc2nc1SCc1cccc(c1)Br

STK547063
Synonyms: 11-(4-chloro-3-nitrophenyl)-3-cyclohexyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: [O-][N+](=O)c1cc(ccc1Cl)n1c2nc3ccccc3nc2c2c1ncn(c2=O)C1CCCCC1

STK547064
Synonyms: 2-amino-4-(4-butoxy-3-methoxyphenyl)-6-sulfanylpyridine-3,5-dicarbonitrile
Smiles: CCCCOc1ccc(cc1OC)c1c(C#N)c(N)nc(c1C#N)S

STK547065
Synonyms: 2-(4-methoxyphenyl)-3-{2-[2-methyl-5-(propan-2-yl)phenoxy]ethyl}quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(ccc1C)C(C)C

STK547067
Synonyms: 1-(3,4-dichlorophenyl)-3-(naphthalen-2-ylamino)pyrrolidine-2,5-dione
Smiles: O=C1CC(C(=O)N1c1ccc(c(c1)Cl)Cl)Nc1ccc2c(c1)cccc2

STK547069
Synonyms: 2-chloro-6,7-dimethoxy-3-[1-(methylsulfonyl)-3-phenyl-4,5-dihydro-1H-pyrazol-5-yl]quinoline
Smiles: COc1cc2cc(c(nc2cc1OC)Cl)C1CC(=NN1S(=O)(=O)C)c1ccccc1

STK547070
Synonyms: N'-[(1Z)-1-(3-bromophenyl)ethylidene]-2-{[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C(\c2cccc(c2)Br)/C)nnc1c1ccc(cc1)C

STK547071
Synonyms: (8S,8aR,11aS)-10-(4-chlorophenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)Cl)cccc3

STK547072
Synonyms: 1-[2-(diethylamino)ethyl]-5-(4-fluorophenyl)-3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCN(CCN1C(=O)C(=C(C1c1ccc(cc1)F)C(=O)c1ccc(cc1)OC)O)CC

STK547073
Synonyms: N,N-diethyl-2-{[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3)CC

STK547074
Synonyms: (2Z)-2-cyano-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-[4-(propan-2-yl)phenyl]prop-2-enamide
Smiles: N#C/C(=C/c1ccc(cc1)C(C)C)/C(=O)Nc1ccc(cc1)c1nc2c(s1)cc(cc2)C

STK547075
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1c1cccnc1

STK547076
Synonyms: N-(diphenylmethyl)-2-{[3-(2-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1ccccc1n1c(SCC(=O)NC(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547077
Synonyms: (8S,8aR,11aS)-10-(3-fluorophenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)F)cccc3

STK547078
Synonyms: 3-[3-(4-chloro-2-methylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1C)Cl

STK547080
Synonyms: 2-methoxyethyl2-amino-1-(2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1OC)OC

STK547082
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(3,5-dichlorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl)cccc3

STK547083
Synonyms: N-benzyl-2-[(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCCn1c(SCC(=O)NCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547084
Synonyms: (8S,8aR,11aS)-10-(2-methoxy-5-nitrophenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1OC)[N+](=O)[O-])cccc3

STK547085
Synonyms: 2-(4-methoxyphenyl)-3-[3-(4-nitrophenoxy)propyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1)[N+](=O)[O-]

STK547086
Synonyms: 1-[(4-tert-butylbenzyl)oxy]-3-(4-phenoxyphenyl)quinoxalin-2(1H)-one4-oxide
Smiles: [O-][n+]1c(c2ccc(cc2)Oc2ccccc2)c(=O)n(c2c1cccc2)OCc1ccc(cc1)C(C)(C)C

STK547087
Synonyms: methyl2-{3-hydroxy-4-[(4-methoxy-2-methylphenyl)carbonyl]-2-oxo-5-(pyridin-3-yl)-2,5-dihydro-1H-pyrrol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COc1ccc(c(c1)C)C(=O)C1=C(O)C(=O)N(C1c1cccnc1)c1sc(c(n1)C)C(=O)OC

STK547089
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-methoxy-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}phenyl)methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1ccc(cc1CSc1nnc(s1)C)/C=N/NC(=O)c1nnn(c1C)c1nonc1N

STK547090
Synonyms: 6-iodo-3-(2-methoxyphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one
Smiles: COc1ccccc1n1c(SCC(=O)c2ccccc2)nc2c(c1=O)cc(cc2)I

STK547091
Synonyms: methyl2-[(3aR,6aS)-3-(3,4-dimethoxyphenyl)-4,6-dioxo-3a,4,6,6a-tetrahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccc(c(c1)OC)OC

STK547092
Synonyms: 5-(2-chlorophenyl)-1-(4-fluorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1Cl)C(=O)c1ccccc1)O

STK547093
Synonyms: 2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N'-[(E)-(2-methoxynaphthalen-1-yl)methylidene]acetohydrazide
Smiles: COc1ccc2c(c1/C=N/NC(=O)CSc1nnc(s1)SCc1ccccc1)cccc2

STK547094
Synonyms: 2-methoxyethyl2-amino-1-(3-chloro-4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)OC

STK547095
Synonyms: (2'R,3'R)-2'-(3-nitrophenyl)-3'-(phenylcarbonyl)-2',3'-dihydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-1,3-dione
Smiles: O=C([C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1cccc(c1)[N+](=O)[O-])C(=O)c1c(C2=O)cccc1)cccc3)c1ccccc1

STK547096
Synonyms: methylcyano[3-(morpholin-4-yl)quinoxalin-2-yl]acetate
Smiles: N#CC(c1nc2ccccc2nc1N1CCOCC1)C(=O)OC

STK547097
Synonyms: 8-(2-methylprop-2-en-1-yl)-9-(prop-2-en-1-ylsulfanyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: C=CCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCc1c3cccc1

STK547098
Synonyms: prop-2-en-1-ylcyano[3-(3,5-dimethylpiperidin-1-yl)quinoxalin-2-yl]acetate
Smiles: C=CCOC(=O)C(c1nc2ccccc2nc1N1CC(C)CC(C1)C)C#N

STK547100
Synonyms: 3-[2-(2-ethoxyphenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: CCOc1ccccc1OCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK547101
Synonyms: 1-(2-hydroxyethyl)-2-imino-N-(2-methoxyethyl)-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: OCCn1c(=N)c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCCOC

STK547102
Synonyms: N-[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-N-[2-(4-methoxyphenyl)ethyl]benzamide
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)c1ccccc1)CCc1ccc(cc1)OC

STK547103
Synonyms: 3-chloro-4-[(4-fluorophenyl)amino]-1-(2-phenylethyl)-1H-pyrrole-2,5-dione
Smiles: Fc1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)CCc1ccccc1

STK547104
Synonyms: N'-{(E)-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]methylidene}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(s2)C)cc(c1OCc1ccccc1)Br

STK547105
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-phenyl-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)c1ccccc1)cccc3

STK547106
Synonyms: N-(2,6-dichlorophenyl)cyclobutanecarboxamide
Smiles: O=C(C1CCC1)Nc1c(Cl)cccc1Cl

STK547108
Synonyms: 1-[1-(1H-benzimidazol-2-yl)ethyl]-3-phenylurea
Smiles: O=C(NC(c1nc2c([nH]1)cccc2)C)Nc1ccccc1

STK547109
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccccc1)c1nonc1N)N/N=C/c1cccc(c1)OCc1ccccc1

STK547110
Synonyms: 1,1'-(9H-fluorene-2,7-diyldisulfonyl)bis[4-(4-chlorobenzyl)piperazine]
Smiles: Clc1ccc(cc1)CN1CCN(CC1)S(=O)(=O)c1ccc2c(c1)Cc1c2ccc(c1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl

STK547111
Synonyms: prop-2-en-1-yl4-[4-(benzyloxy)-3-methoxyphenyl]-5-cyano-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C#N)SCC(=O)OC

STK547112
Synonyms: (8R,8aS,11aR,11bR)-8-[(3-bromo-4-methoxyphenyl)carbonyl]-10-(2,4-dimethylphenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2C=Cc3c([C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3

STK547113
Synonyms: ethyl2-{[6-iodo-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydroquinazolin-2-yl]sulfanyl}propanoate
Smiles: C=CCn1c(SC(C(=O)OCC)C)nc2c(c1=O)cc(cc2)I

STK547114
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)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: Clc1ccc(cc1)C(=O)[C@@H]1[C@H]2[C@@H](C3N1N=Cc1c3cccc1)C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-]

STK547115
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(2,4-dichlorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]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)c1ccc(cc1Cl)Cl)cccc3

STK547119
Synonyms: 2-[(4-amino-6,8-diphenyl-5,8-dihydro-6H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1

STK547120
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-butyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547123
Synonyms: 2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCn1c(SCC(=O)N2CCCCC2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547125
Synonyms: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]acetohydrazide
Smiles: O=C(CSc1nc(C)cc(n1)C)N/N=C/C=C/c1ccccc1

STK547126
Synonyms: 2-[(2-butyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(diphenylmethyl)acetamide
Smiles: CCCCc1nc(SCC(=O)NC(c2ccccc2)c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C

STK547127
Synonyms: 2-(2-{5-[(4-methylphenyl)sulfanyl]-3-nitro-1H-1,2,4-triazol-1-yl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CCn2nc(nc2Sc2ccc(cc2)C)[N+](=O)[O-])C(=O)c2c1cccc2

STK547129
Synonyms: N-(9H-xanthen-9-yl)dodecanamide
Smiles: CCCCCCCCCCCC(=O)NC1c2ccccc2Oc2c1cccc2

STK547130
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(4-fluorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)N=Cc2c1cccc2

STK547131
Synonyms: N-{1-(3-methoxypropyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}naphthalene-2-sulfonamide
Smiles: COCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc2c(c1)cccc2)S(=O)(=O)c1ccc(cc1)C

STK547132
Synonyms: 4-methylbenzylN'-cyano-N-(4-ethoxyphenyl)carbamimidothioate
Smiles: CCOc1ccc(cc1)N/C(=N/C#N)/SCc1ccc(cc1)C

STK547133
Synonyms: 2-amino-1-butyl-N-hexyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCNC(=O)c1c2nc3ccccc3nc2n(c1N)CCCC

STK547134
Synonyms: [3-(3-{[(2-methylphenyl)carbonyl]amino}pyridinium-1-yl)quinoxalin-2-yl](phenylsulfonyl)azanide
Smiles: O=C(c1ccccc1C)Nc1ccc[n+](c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1

STK547135
Synonyms: 6-chloro-3-[5-(3,4-dimethoxyphenyl)-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenylquinolin-2(1H)-one
Smiles: COc1cc(ccc1OC)C1CC(=NN1S(=O)(=O)C)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

STK547136
Synonyms: 2-[3-(4-benzylpiperidin-1-yl)quinoxalin-2-yl]-2-cyano-N-(1-phenylethyl)acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCC(CC1)Cc1ccccc1)C(=O)NC(c1ccccc1)C

STK547137
Synonyms: methyl5-(4-ethylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)C(=NN2)C(=O)OC

STK547139
Synonyms: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)acetamide
Smiles: N#Cc1cc2CCCc2nc1SCC(=O)Nc1sc2c(c1C#N)CCC2

STK547140
Synonyms: N-{(E)-[4-(dodecyloxy)phenyl]methylidene}-4-[(4-methyl-3,6-dihydro-2H-pyran-3-yl)oxy]aniline
Smiles: CCCCCCCCCCCCOc1ccc(cc1)/C=N/c1ccc(cc1)OC1COCC=C1C

STK547141
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(2-chloro-6-fluorobenzyl)oxy]-3-methoxyphenyl}methylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCc1c(F)cccc1Cl

STK547142
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1O)OC

STK547143
Synonyms: 2-{[4-(4-bromophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK547144
Synonyms: 4-hydroxy-11-(thiophen-2-yl)-7,8,9,10-tetrahydropyrido[2',3':4,5]thieno[2,3-b]quinolin-2(1H)-one
Smiles: O=c1cc(O)c2c([nH]1)c1c(s2)nc2c(c1c1cccs1)CCCC2

STK547145
Synonyms: 3-[3-(2-ethoxyphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: CCOc1ccccc1OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK547146
Synonyms: N-[(4-benzylpiperidin-1-yl)methyl]pyridine-3-carboxamide
Smiles: O=C(c1cccnc1)NCN1CCC(CC1)Cc1ccccc1

STK547147
Synonyms: ethyl4-{[4-(benzyloxy)phenyl]amino}-6-methylquinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)OCc1ccccc1)cc(cc2)C

STK547148
Synonyms: 3-[2-(4-chlorophenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1)Cl

STK547149
Synonyms: 2-amino-1-(2-methoxybenzyl)-N-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccccc1NC(=O)c1c2nc3ccccc3nc2n(c1N)Cc1ccccc1OC

STK547150
Synonyms: 1-(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)c(n2Cc1ccccc1)C

STK547151
Synonyms: 4-[4-(4-fluorobenzyl)piperazin-1-yl]-5-phenylthieno[2,3-d]pyrimidine
Smiles: Fc1ccc(cc1)CN1CCN(CC1)c1ncnc2c1c(cs2)c1ccccc1

STK547152
Synonyms: ethyl2-[({[3-cyano-6-(thiophen-2-yl)-4-(thiophen-3-yl)pyridin-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc(cc(c2C#N)c2cscc2)c2cccs2)sc2c1CCCC2

STK547153
Synonyms: N-({2-[(2,4-dichlorophenyl)carbonyl]hydrazinyl}carbonothioyl)-2-(thiophen-2-yl)acetamide
Smiles: O=C(Cc1cccs1)NC(=S)NNC(=O)c1ccc(cc1Cl)Cl

STK547154
Synonyms: [(4-chlorophenyl)sulfonyl][1,4-dioxo-3-(pyridinium-1-yl)-1,4-dihydronaphthalen-2-yl]azanide
Smiles: Clc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccccc2)C(=O)c2c(C1=O)cccc2

STK547155
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl]acetamide
Smiles: N#Cc1c(NC(=O)CSc2nc(C)c(c(c2C#N)C)C)sc2c1CCC2

STK547156
Synonyms: methyl2-({1,1,1,3,3,3-hexafluoro-2-[(furan-2-ylcarbonyl)amino]propan-2-yl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccco1

STK547157
Synonyms: 5-[(2,4-dichlorophenyl)amino]-2-ethyl-5-oxopentanoicacid
Smiles: CCC(C(=O)O)CCC(=O)Nc1ccc(cc1Cl)Cl

STK547160
Synonyms: N-({2-[(5-chloro-2-methoxyphenyl)carbonyl]hydrazinyl}carbonothioyl)-3,4-difluorobenzamide
Smiles: COc1ccc(cc1C(=O)NNC(=S)NC(=O)c1ccc(c(c1)F)F)Cl

STK547162
Synonyms: 2-methoxyethyl2-amino-1-(1,3-benzodioxol-5-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCO2

STK547163
Synonyms: N-(2,4-dimethoxyphenyl)-11-(2-fluorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2F)c(nn1c1ccccc1)C

STK547164
Synonyms: 2-{[4-(4-bromophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK547165
Synonyms: 2-amino-6-[(2-bromobenzyl)sulfanyl]-4-(thiophen-2-yl)pyridine-3,5-dicarbonitrile
Smiles: N#Cc1c(SCc2ccccc2Br)nc(c(c1c1cccs1)C#N)N

STK547166
Synonyms: 4-chloro-N-{1-(3-methylbutyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzenesulfonamide
Smiles: CC(CCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)Cl)S(=O)(=O)c1ccc(cc1)C)C

STK547167
Synonyms: 4-[(E)-{2-[5-(ethoxycarbonyl)-4-methyl-1,3-thiazol-2-yl]hydrazinylidene}methyl]benzoicacid
Smiles: CCOC(=O)c1sc(nc1C)N/N=C/c1ccc(cc1)C(=O)O

STK547169
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)OC)nnc1c1cccnc1

STK547170
Synonyms: 4-amino-N'-[(E)-{3-bromo-5-methoxy-4-[(3-methylbenzyl)oxy]phenyl}methylidene]-1,2,5-oxadiazole-3-carbohydrazonamide
Smiles: COc1cc(/C=N/N=C(\c2nonc2N)/N)cc(c1OCc1cccc(c1)C)Br

STK547171
Synonyms: 4-acetyl-5-(2-chlorophenyl)-3-hydroxy-1-(2-phenylethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1N(CCc2ccccc2)C(C(=C1O)C(=O)C)c1ccccc1Cl

STK547172
Synonyms: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-diphenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: COc1cc2c(cc1OC)CCNC2c1c(O)n(c2ccccc2)c(=S)n(c1=O)c1ccccc1

STK547173
Synonyms: 2-{[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)OCO3)nc2c(c1=O)cccc2

STK547174
Synonyms: N-(4-chlorophenyl)-4-[4-(prop-2-yn-1-yloxy)phenyl]phthalazin-1-amine
Smiles: C#CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc(cc1)Cl

STK547175
Synonyms: N,N-dibutyl-2-[(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: CCCCn1c(SCC(=O)N(CCCC)CCCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547176
Synonyms: 6-amino-4-(4-butoxy-3-methoxyphenyl)-3-(propan-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCCOc1ccc(cc1OC)C1C(=C(N)Oc2c1c([nH]n2)C(C)C)C#N

STK547177
Synonyms: 3-[3-(2,6-dichlorophenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(Cl)cccc1Cl

STK547178
Synonyms: 2-{[4-(4-bromophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-chloro-4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK547179
Synonyms: 4-{2-[(2E)-2-(3-bromobenzylidene)hydrazinyl]-2-oxoethoxy}-N'-[(E)-(3-bromophenyl)methylidene]benzohydrazide
Smiles: O=C(COc1ccc(cc1)C(=O)N/N=C/c1cccc(c1)Br)N/N=C/c1cccc(c1)Br

STK547180
Synonyms: 2-{[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(2-methoxybenzyl)acetamide
Smiles: COc1ccccc1CNC(=O)CSc1nc(N)c(c(c1C#N)c1cccs1)C#N

STK547181
Synonyms: 4-[(4-chlorophenyl)carbonyl]-5-(4-fluorophenyl)-3-hydroxy-1-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)N1C(c2ccc(cc2)F)C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK547182
Synonyms: N-ethyl-2-imino-1-(4-methoxybenzyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: CCNC(=O)c1cc2c(n(c1=N)Cc1ccc(cc1)OC)nc1n(c2=O)cccc1

STK547183
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,5-dichloro-2-methoxyphenyl)methylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)cc(cc1Cl)Cl

STK547184
Synonyms: 3-ethyl6-methyl4-[(3,5-dimethylphenyl)amino]quinoline-3,6-dicarboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1cc(C)cc(c1)C)cc(cc2)C(=O)OC

STK547185
Synonyms: (3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(2-methyl-5-nitrophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-])C(=O)c1ccccc1

STK547186
Synonyms: 3-[(diethylamino)methyl]-2,6,8-trimethylquinolin-4-ol
Smiles: CCN(Cc1c(C)nc2c(c1O)cc(cc2C)C)CC

STK547187
Synonyms: propan-2-yl2-amino-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CC(Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)OC(C)C)C

STK547189
Synonyms: 2-(benzylsulfanyl)-3-butyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCn1c(SCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547190
Synonyms: 3-methyl-2-(2-methylprop-2-en-1-yl)-1-{[2-(morpholin-4-yl)ethyl]amino}pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#Cc1c(C)c(CC(=C)C)c(n2c1nc1c2cccc1)NCCN1CCOCC1

STK547191
Synonyms: 8-(2-methylprop-2-en-1-yl)-9-(pentylsulfanyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCCCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCc1c3cccc1

STK547192
Synonyms: 5-[4-(decyloxy)phenyl]-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCCCCCCCCCOc1ccc(cc1)c1n[nH]c(=S)n1CC=C

STK547193
Synonyms: 4-(2,5-dimethylpiperidin-1-yl)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC1CCC(N(C1)c1ncnc2c1sc1c2cc2c(n1)CC(OC2)(C)C)C

STK547195
Synonyms: 5-(2-chlorophenyl)-1-(4-fluorophenyl)-3-hydroxy-4-[(4-methylphenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1Cl)c1ccc(cc1)F

STK547196
Synonyms: 2-methoxyethyl2-amino-1-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)OC

STK547197
Synonyms: 4-[(3S)-2,2-dicyano-3-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)cyclopropyl]phenylacetate
Smiles: N#CC1(C#N)[C@H](C1c1ccc(cc1)OC(=O)C)C(=O)C12CC3CC(C2)CC(C1)C3

STK547198
Synonyms: 2-benzyl-3-methyl-1-[(2,4,5-trichlorophenyl)amino]pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#Cc1c(C)c(Cc2ccccc2)c(n2c1nc1c2cccc1)Nc1cc(Cl)c(cc1Cl)Cl

STK547199
Synonyms: (8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(4-methylphenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)N=Cc2c1cccc2

STK547201
Synonyms: N-[3-cyano-1-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl]-4-fluorobenzenesulfonamide
Smiles: N#Cc1c(NS(=O)(=O)c2ccc(cc2)F)n(c2c1nc1ccccc1n2)c1ccccc1OC

STK547202
Synonyms: ethyl5-bromo-3-[(2-bromohexanoyl)amino]-1H-indole-2-carboxylate
Smiles: CCCCC(C(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OCC)Br

STK547203
Synonyms: 1-(2-chlorobenzyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1Cl

STK547204
Synonyms: N-(3-bromophenyl)-4-[4-(prop-2-yn-1-yloxy)phenyl]phthalazin-1-amine
Smiles: C#CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1cccc(c1)Br

STK547205
Synonyms: 1-butyl-5-(4-fluorophenyl)-3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCN1C(c2ccc(cc2)F)C(=C(C1=O)O)C(=O)c1ccc(cc1)OC

STK547206
Synonyms: 3-[(4-chlorophenyl)sulfonyl]-1-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: Clc1ccc(cc1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1

STK547207
Synonyms: (8S,8aR,11aS)-10-(1,3-benzodioxol-5-yl)-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)c1ccc2c(c1)OCO2)cccc3