FULL DB

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

STK593538
Synonyms: 1-(4-ethoxyphenyl)-2-(6-fluoro-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593539
Synonyms: methyl4-[7-chloro-3,9-dioxo-2-(pyridin-3-ylmethyl)-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK593540
Synonyms: (3a'S,6a'R)-5'-cyclopentyl-3'-(3,4-dihydroxybenzyl)-5-fluoro-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C1CCCC1)Cc1ccc(c(c1)O)O)C(=O)N2

STK593541
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Smiles: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CCn1nnc2c(c1=O)cccc2

STK593543
Synonyms: 2-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-2-ylmethyl)acetamide
Smiles: O=C(NCc1ccccn1)COc1ccc2c(c1)oc(=O)cc2C

STK593547
Synonyms: 6,8-dibromo-N-hexyl-2,4-dihydroxyquinoline-3-carboxamide
Smiles: CCCCCCNC(=O)c1c(O)nc2c(c1O)cc(cc2Br)Br

STK593549
Synonyms: 4-(4-chlorophenyl)-N-cyclohexyl-1-(4-ethoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)NC2CCCCC2)n2c3c1CCCCn3c(c2)c1ccc(cc1)Cl

STK593550
Synonyms: 8-(4-ethoxyphenyl)-1-methyl-3-(2-phenylethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK593553
Synonyms: 6-hydroxy-7-[2-hydroxy-3-(naphthalen-2-yloxy)propyl]-8-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COc1ccc(cc1)N1CCN(CC1)c1nc2c(n1CC(COc1ccc3c(c1)cccc3)O)c(O)nc(=O)n2C

STK593554
Synonyms: N-(4-butoxyphenyl)-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: CCCCOc1ccc(cc1)NC(=O)CCCn1cnc2c(c1=O)cccc2

STK593555
Synonyms: 5-(thiophen-2-yl)-1,3,4-thiadiazole-2-thiol
Smiles: Sc1nnc(s1)c1cccs1

STK593556
Synonyms: 4-(4-methoxyphenyl)-3-(3-methylphenyl)-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(SCc2cccc(c2)C(F)(F)F)nnc1c1cccc(c1)C

STK593559
Synonyms: (3a'S,6a'R)-5'-[2-(3,4-dimethoxyphenyl)ethyl]-5-fluoro-3'-(2-methylpropyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3CC(C)C)C(=O)Nc3c2cc(F)cc3)ccc1OC

STK593560
Synonyms: 4-hydroxy-2-(methylsulfanyl)-5-(2,4,5-trimethoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: CSc1nc(O)c2c(n1)NC(=O)CC2c1cc(OC)c(cc1OC)OC

STK593562
Synonyms: 2,2,5-trimethyl-8-(4-methylpiperidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC1CCN(CC1)c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C

STK593563
Synonyms: N-(4-ethoxyphenyl)-2-({5-[(4-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK593564
Synonyms: 9-(2,5-dimethoxyphenyl)-2-(ethylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1cc(OC)ccc1OC

STK593565
Synonyms: (2-benzyl-4-hydroxy-1,1-dioxido-2H-1,2-benzothiazin-3-yl)(morpholin-4-yl)methanone
Smiles: O=C(C1=C(O)c2ccccc2S(=O)(=O)N1Cc1ccccc1)N1CCOCC1

STK593567
Synonyms: 2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-ethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1)C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593568
Synonyms: 5-(4-ethoxyphenyl)-4-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1N/N=C/c1cccnc1

STK593569
Synonyms: N-(2-chlorophenyl)-4-(4-methylphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1Cl)c1ccccc1

STK593570
Synonyms: (1'S,3R,3'S,7a'R)-5'',7''-dimethyl-1'-[(4-propoxyphenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(C)cc1C

STK593571
Synonyms: 2-{[5-(2-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(n1Cc1ccco1)c1ccccc1Cl

STK593572
Synonyms: (4E)-5-[4-(dimethylamino)phenyl]-1-hexyl-4-[hydroxy(4-methylphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1)N(C)C

STK593576
Synonyms: 1-(4-ethoxy-3-methoxyphenyl)-7-fluoro-2-(6-methylpyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1OC)C1N(c2cccc(n2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK593577
Synonyms: (4E)-2-(2-ethylphenyl)-4-{[(2-hydroxyethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: OCCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccccc1CC

STK593578
Synonyms: 2-[(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino]butan-1-ol
Smiles: CCC(Nc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1)CO

STK593579
Synonyms: 2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1Cc1cccs1

STK593580
Synonyms: 8-[4-(4-fluorobenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: Fc1ccc(cc1)CN1CCN(CC1)c1nc2c(n1CC(=C)C)c(O)nc(=O)n2C

STK593581
Synonyms: 6-(3-chlorophenyl)-9-(4-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Oc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1cccc(c1)Cl

STK593583
Synonyms: 4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl6-[(tert-butoxycarbonyl)amino]hexanoate
Smiles: O=C(Oc1ccc2c(c1C)oc(=O)c1c2CCCC1)CCCCCNC(=O)OC(C)(C)C

STK593584
Synonyms: 4-(3-chlorophenyl)-8-methyl-1-[(3-methylbutyl)sulfanyl]-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(CCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)Cl)CCN(C3)C)C

STK593585
Synonyms: (3a'S,6a'R)-5-bromo-5'-tert-butyl-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Brc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C(C)(C)C)C(C)C)C(=O)N2

STK593587
Synonyms: (E)-{1-[3-(diethylammonio)propyl]-2-(2,5-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[3-fluoro-4-(propan-2-yloxy)phenyl]methanolate
Smiles: CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)F)OC(C)C)/[O-])/C1c1cc(OC)ccc1OC)CC

STK593588
Synonyms: 3,6-diamino-5-cyano-N-{2-[(4-fluorobenzyl)sulfanyl]phenyl}thieno[2,3-b]pyridine-2-carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)Nc1ccccc1SCc1ccc(cc1)F

STK593589
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(2-chlorophenyl)carbonyl]-3'-[(4-fluorophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Fc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1Cl)C(=O)Nc1c2cccc1)cccc3

STK593590
Synonyms: [(4Z)-4-(hydroxyimino)-3,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-2-yl](4-phenylpiperazin-1-yl)methanone
Smiles: O/N=C\1/CC(C)(C)Cc2c1c(C)c(o2)C(=O)N1CCN(CC1)c1ccccc1

STK593591
Synonyms: N-(2-tert-butylphenyl)-2-{[5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1c1ccc(cc1)F

STK593592
Synonyms: 2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-[(2Z)-4-(4-methylphenyl)-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: COc1ccc(cc1)N1CCN(CC1)CC(=O)/N=c/1\scc([nH]1)c1ccc(cc1)C

STK593593
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-[4-(prop-2-en-1-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: C=CCOc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593595
Synonyms: 1-[1-hydroxy-11-(4-methoxyphenyl)-3-methyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2-phenoxyethanone
Smiles: COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)COc1ccccc1)cccc2)C

STK593596
Synonyms: ethyl4-oxo-2-(2-oxo-2-phenylethyl)-4-phenylbutanoate
Smiles: CCOC(=O)C(CC(=O)c1ccccc1)CC(=O)c1ccccc1

STK593597
Synonyms: N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylpropyl)thiophene-2-carboxamide
Smiles: CC(CN(C(=O)c1cccs1)Cc1cc2ccc(cc2[nH]c1=O)C)C

STK593598
Synonyms: N-[(2Z)-3-(5-chloro-2-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclopropanecarboxamide
Smiles: COc1ccc(cc1N1/C(=N/C(=O)C2CC2)/SC2C1CS(=O)(=O)C2)Cl

STK593601
Synonyms: ethyl2-{[(Z)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]amino}-5-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1cc(sc1N/C=C\1/C(=NC(=NC1=O)S)O)C

STK593602
Synonyms: 5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinolin-8-ol
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3O

STK593603
Synonyms: 1-benzyl-6-cyclohexyl-2-hydroxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(O)n(c2c1CN(CN2)C1CCCCC1)Cc1ccccc1

STK593604
Synonyms: 4-(9,10-dimethoxy-3,3-dimethyl-1-oxo-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-13-yl)-1,5-dimethyl-1H-pyrrole-2-carbonitrile
Smiles: COc1cc2CCN3C(=CC(C4=C3CC(C)(C)CC4=O)c3cc(n(c3C)C)C#N)c2cc1OC

STK593606
Synonyms: 2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2OC)OC)N=C2C(=C(O)CCC2)C1c1ccco1

STK593608
Synonyms: 4-tert-butyl-N-{1-methyl-4-oxo-3-[3-(trifluoromethyl)phenyl]-1,4-dihydroquinolin-2-yl}benzamide
Smiles: O=C(c1ccc(cc1)C(C)(C)C)Nc1n(C)c2ccccc2c(=O)c1c1cccc(c1)C(F)(F)F

STK593609
Synonyms: methyl(8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate
Smiles: COC(=O)Cn1c(CN2CCN(CC2)c2ccc(cc2)OC)nc2c1c(=O)n(c(=O)n2C)C

STK593611
Synonyms: (1Z)-1-{(2Z)-[4-(4-methylphenyl)-1,3-thiazol-2(3H)-ylidene]hydrazinylidene}-1H-isoindol-3-amine
Smiles: Cc1ccc(cc1)c1cs/c(=N\N=C\2/N=C(c3c2cccc3)N)/[nH]1

STK593612
Synonyms: 4-methoxy-N-[(3E)-7-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CCCn1[nH]/c(=N/S(=O)(=O)c2ccc(cc2)OC)/c2c1nc1cc(C)ccc1c2

STK593614
Synonyms: 2,2'-{[(10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl]imino}diethanol
Smiles: OCCN(Cc1nc2n(n1)cnc1c2c2CC(C)(C)OCc2s1)CCO

STK593615
Synonyms: 2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: N#CC1=C(SCC(=O)N(c2ccccc2)c2ccccc2)N=C2C(=C(O)CCC2)C1c1ccco1

STK593616
Synonyms: 2-[10-(4-methoxyphenyl)-2,6,8-trioxo-3,4a,5,5a,6,8,8a,9,9a,10-decahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindol-7(2H)-yl]propanoicacid
Smiles: COc1ccc(cc1)C1C2C(Sc3c1sc(=O)[nH]3)C1CC2C2C1C(=O)N(C2=O)C(C(=O)O)C

STK593617
Synonyms: N-[(3E)-1-ethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c\1/[nH]n(c2c1cc1ccccc1n2)CC

STK593618
Synonyms: (4E)-5-(4-bromophenyl)-1-(furan-2-ylmethyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: Brc1ccc(cc1)C1/C(=C(/c2cccc(c2)[N+](=O)[O-])\O)/C(=O)C(=O)N1Cc1ccco1

STK593619
Synonyms: 5-(4-fluorophenyl)-4-{[(E)-(3-methoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F

STK593620
Synonyms: N-(5-chloro-2-methylphenyl)-2-({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)C

STK593623
Synonyms: 4-methyl-N'-[(E)-quinoxalin-6-ylmethylidene]benzenesulfonohydrazide
Smiles: Cc1ccc(cc1)S(=O)(=O)N/N=C/c1ccc2c(c1)nccn2

STK593627
Synonyms: 8-bromo-7-{3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methylpropyl}-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CC(Cn1c(Br)nc2c1c(O)nc(=O)n2C)CSc1nc(C)cc(n1)C

STK593629
Synonyms: N~5~,N~5~-diethyl-2,1,3-benzoxadiazole-4,5-diamine
Smiles: CCN(c1ccc2c(c1N)non2)CC

STK593632
Synonyms: 13-(2-bromophenyl)-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one
Smiles: COc1cc2c(cc1OC)CCN1C2=CC(C2=C1CC(CC2=O)(C)C)c1ccccc1Br

STK593634
Synonyms: N-(4-{[(4E)-6-bromo-2-(4-methoxyphenyl)-4H-chromen-4-ylidene]amino}phenyl)acetamide
Smiles: COc1ccc(cc1)c1c/c(=N\c2ccc(cc2)NC(=O)C)/c2c(o1)ccc(c2)Br

STK593635
Synonyms: 13-(8-bromo-2,3-dihydro-1,4-benzodioxin-6-yl)-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one
Smiles: COc1cc2CCN3C(=CC(C4=C3CC(C)(C)CC4=O)c3cc(Br)c4c(c3)OCCO4)c2cc1OC

STK593637
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2-chlorophenyl)carbonyl]-2'-(furan-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Clc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)cccc3

STK593639
Synonyms: N-(3-chloro-2-methylphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)Cl)nnc1c1ccccn1

STK593640
Synonyms: 3-fluoro-N-{[(2Z)-4-(3-nitrophenyl)-1,3-thiazol-2(3H)-ylidene]carbamothioyl}benzamide
Smiles: Fc1cccc(c1)C(=O)NC(=S)/N=c/1\scc([nH]1)c1cccc(c1)[N+](=O)[O-]

STK593642
Synonyms: N-butyl-5,7-dimethyl-N-(thiophen-2-ylmethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: CCCCN(C(=O)c1nn2c(n1)nc(cc2C)C)Cc1cccs1

STK593643
Synonyms: N-[(2Z)-3-(3,4-dimethoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclopropanecarboxamide
Smiles: COc1cc(ccc1OC)CN1/C(=N/C(=O)C2CC2)/SC2C1CS(=O)(=O)C2

STK593645
Synonyms: (5E)-3-cyclohexyl-6-hydroxy-5-{1-[(3-hydroxypropyl)amino]propylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: OCCCN/C(=C/1\C(=NC(=O)N(C1=O)C1CCCCC1)O)/CC

STK593647
Synonyms: 2-hydroxy-N'-[(E)-quinolin-4-ylmethylidene]benzohydrazide
Smiles: O=C(c1ccccc1O)N/N=C/c1ccnc2c1cccc2

STK593649
Synonyms: 4-methoxy-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)benzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)Cc1cccnc1

STK593650
Synonyms: (3a'S,6a'R)-5'-butyl-5-chloro-3'-(4-hydroxybenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(Cl)cc2

STK593652
Synonyms: 4,5,6-trimethoxy-N'-[(E)-(4-methoxyphenyl)methylidene]-1H-indole-2-carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC

STK593654
Synonyms: 2-(2-methoxy-5-{(E)-[1-(3-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}benzyl)-1H-isoindole-1,3(2H)-dione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C)S

STK593656
Synonyms: N-[(2Z)-3-(4-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: COc1ccc(cc1)CN1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK593658
Synonyms: (4Z)-4-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-(2-chlorophenyl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\1/C=C(Oc2c1cccc2)c1ccc2c(c1)OCO2)c1ccccc1Cl

STK593659
Synonyms: 3-[(3-bromobenzyl)oxy]-1-hydroxy-5-methyl-9H-xanthen-9-one
Smiles: Brc1cccc(c1)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK593661
Synonyms: N-(3-chloro-2-methylphenyl)-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=S)Nc1cccc(c1C)Cl

STK593662
Synonyms: 2-(4-nitrophenyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: [O-][N+](=O)c1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK593664
Synonyms: 7-butyl-1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCn1c(CN2CCCCC2C)nc2c1c(=O)n(c(=O)n2C)C

STK593666
Synonyms: N-(2-bromophenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccccc1Br

STK593668
Synonyms: methyl[(2,12,12-trimethyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CC(OC3)(C)C

STK593669
Synonyms: 8-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-7-(4-fluorobenzyl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Fc1ccc(cc1)Cn1c(N/N=C/c2ccc(cc2)Cl)nc2c1c(O)nc(=O)n2C

STK593671
Synonyms: N'-[(E)-{4,6-dioxo-2-sulfanyl-1-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidin-5(4H)-ylidene}methyl]benzohydrazide
Smiles: O=C(c1ccccc1)NN/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)S

STK593672
Synonyms: 7-(2-ethoxyethyl)-6-hydroxy-3-methyl-8-(pentylsulfanyl)-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCSc1nc2c(n1CCOCC)c(O)nc(=O)n2C

STK593675
Synonyms: 3-(2,5-dimethylbenzyl)-8-(3-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cc(C)ccc1C

STK593676
Synonyms: 7-(morpholin-4-yl)-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC(c1nc2oc3c(c2c2c1CCC2)ncnc3N1CCOCC1)C

STK593677
Synonyms: methylN-[(2-ethylphenyl)carbamoyl]-D-valinate
Smiles: COC(=O)[C@@H](C(C)C)NC(=O)Nc1ccccc1CC

STK593678
Synonyms: 4-(9-benzyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol
Smiles: Oc1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCN(C2)Cc1ccccc1

STK593679
Synonyms: 1-(3-chlorophenyl)-2-(6-methoxy-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1)Cl)c(=O)c1c(o2)cccc1

STK593686
Synonyms: 4-chloro-N-[5-(4-chlorophenyl)-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzenesulfonamide
Smiles: Clc1ccc(cc1)C1=CC(n2c(=N1)[nH]c(n2)NS(=O)(=O)c1ccc(cc1)Cl)c1ccccc1

STK593687
Synonyms: (3a'S,6a'R)-7-chloro-3'-methyl-5'-(2-phenylethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cccc1Cl

STK593688
Synonyms: N-(3-chlorophenyl)-3-(2-methyl-1H-benzimidazol-1-yl)propanamide
Smiles: O=C(Nc1cccc(c1)Cl)CCn1c(C)nc2c1cccc2

STK593691
Synonyms: 2-[(3a'S,6a'R)-5-fluoro-5'-(4-methoxybenzyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: COc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(F)cc2

STK593693
Synonyms: 2-[(4,7-dimethylquinazolin-2-yl)amino]-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimidin-4-ol
Smiles: Oc1cc(CSc2nnc(s2)C)nc(n1)Nc1nc(C)c2c(n1)cc(cc2)C

STK593694
Synonyms: 7,7-dimethyl-2-(3-methylphenyl)-4-(prop-2-en-1-ylsulfanyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: C=CCSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C

STK593695
Synonyms: (4E)-2-(2,4-dimethylphenyl)-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)/C(=C/NCCCN2CCOCC2)/c2c(C1=O)cccc2

STK593696
Synonyms: 1-(2-methylprop-2-en-1-yl)-6-propyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2CC(=C)C)S

STK593698
Synonyms: N-(2-chlorophenyl)-1-(4-chlorophenyl)-4-(4-fluorophenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Fc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1Cl)c1ccc(cc1)Cl

STK593699
Synonyms: 4-({[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(cc2)C#N)nc2c(c1=O)c1CCCCc1s2

STK593700
Synonyms: 7-methoxy-2-methyl-3-(1-phenyl-1H-pyrazol-4-yl)-4H-chromene-4-thione
Smiles: COc1ccc2c(c1)oc(c(c2=S)c1cnn(c1)c1ccccc1)C

STK593701
Synonyms: N-(3,4-difluorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccc(c(c1)F)F

STK593702
Synonyms: N-[(2E)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-4-phenylbutanamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccccc1)CS(=O)(=O)C2)CCCc1ccccc1

STK593704
Synonyms: 5-(2-chlorophenyl)-4-{[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: C/C(=C\c1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK593705
Synonyms: 5-(3-methylphenyl)-4-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1c(ccc(c1OC)OC)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK593706
Synonyms: 1,4-dimethyl-2-oxo-5-{(Z)-[4-oxo-3-(3-phenylpropyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-6-(thiomorpholin-4-yl)-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCCc2ccccc2)c(n(c1=O)C)N1CCSCC1

STK593707
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK593710
Synonyms: N-(4-chlorophenyl)-2-({6-cyano-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamide
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)Nc3ccc(cc3)Cl)nnc2c2c1CC(C)(C)OC2

STK593711
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK593712
Synonyms: N-(3-chloro-4-fluorophenyl)-2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK593714
Synonyms: 8-(hexylsulfanyl)-6-hydroxy-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCCSc1nc2c(n1CCOC)c(O)nc(=O)n2C

STK593715
Synonyms: 4-(benzylsulfanyl)-7,7-dimethyl-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: Cc1ccc(cc1)c1nc(SCc2ccccc2)c2c(n1)CC(OC2)(C)C

STK593716
Synonyms: (3a'S,6a'R)-5'-(butan-2-yl)-5-chloro-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(CC)C)C(=O)Nc1c2cc(Cl)cc1

STK593719
Synonyms: 2-(5-cyano-1,2-dimethyl-1H-pyrrol-3-yl)-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: COc1cc2CCn3c(c2cc1OC)cc(c(c3=N)C#N)c1cc(n(c1C)C)C#N

STK593722
Synonyms: (2Z)-2-(3-bromobenzylidene)-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: Brc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]

STK593723
Synonyms: 2-[(2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-4-ylmethyl)acetamide
Smiles: O=C(NCc1ccncc1)COc1ccc2c(c1)oc(=O)cc2

STK593725
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-thiophen-2-ylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/c1cccs1

STK593726
Synonyms: (5E)-6-hydroxy-5-({[2-(piperazin-1-yl)ethyl]amino}methylidene)-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C\NCCN2CCNCC2)/C1=O)O

STK593727
Synonyms: 2-({4-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-ethoxyphenyl)acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccc(cc1)C

STK593728
Synonyms: N-(4-ethoxyphenyl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK593730
Synonyms: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-2-(3-bromophenyl)-3-(1,3-thiazol-2-yl)-3,5-dihydro-4H-imidazol-4-one
Smiles: Brc1cccc(c1)C1=N/C(=C\c2ccc3c(c2)OCO3)/C(=O)N1c1nccs1

STK593731
Synonyms: 5-ethoxy-N'-[(E)-(2-hydroxyphenyl)methylidene]-1H-indole-2-carbohydrazide
Smiles: CCOc1ccc2c(c1)cc([nH]2)C(=O)N/N=C/c1ccccc1O

STK593733
Synonyms: 1-(4-fluorophenyl)-1'-methyl-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCC1N(C)c2ccc(cc2CC21C(=O)NC(=O)N(C2=O)c1ccc(cc1)F)[N+](=O)[O-]

STK593735
Synonyms: N-[(2S)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanoyl]-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C(C)C

STK593736
Synonyms: N,N-diethyl-N'-(8-propyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)ethane-1,2-diamine
Smiles: CCCN1CCc2c(C1)sc1c2c(NCCN(CC)CC)nc2n1nnn2

STK593737
Synonyms: (Z)-N-{[11-(2-chlorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}-1-phenylmethanimine
Smiles: Clc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CO/N=C\c1ccccc1)c1ccccc1

STK593741
Synonyms: (4-chloro-3-nitrophenyl)(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2CCN(C(=C)c2cc1OC)C(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STK593742
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(quinolin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1c1ccc2c(c1)OCCO2)c1ccc2c(n1)cccc2

STK593743
Synonyms: 6-oxo-6H-benzo[c]chromen-3-yl2-{[(benzyloxy)carbonyl]amino}butanoate
Smiles: CCC(C(=O)Oc1ccc2c(c1)oc(=O)c1c2cccc1)NC(=O)OCc1ccccc1

STK593744
Synonyms: 2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)-N-(2,3,4-trifluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1F)F)F)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK593745
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK593746
Synonyms: (3S,3'S,3a'R,6a'S)-7-chloro-3'-(2-methylpropyl)-5'-(prop-2-en-1-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: C=CCN1C(=O)[C@@H]2[C@H](C1=O)[C@@]1(N[C@H]2CC(C)C)C(=O)Nc2c1cccc2Cl

STK593747
Synonyms: 2-({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(naphthalen-1-yl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc3c2cccc3)nnc1COc1ccc(cc1)C

STK593748
Synonyms: 8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)C)c(=O)n(c(=O)n2C)C

STK593749
Synonyms: 6-(2,6-dimethylmorpholin-4-yl)-5-[(Z)-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCc2ccc(cc2)OC)c(n(c1=O)C)N1CC(C)OC(C1)C

STK593751
Synonyms: (3a'S,6a'R)-5'-[2-(3,4-dimethoxyphenyl)ethyl]-5-fluoro-3'-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3C)C(=O)Nc3c2cc(F)cc3)ccc1OC

STK593753
Synonyms: N-[(2E)-5-{[2-(dibenzo[b,d]furan-3-ylamino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylpropanamide
Smiles: O=C(Nc1ccc2c(c1)oc1c2cccc1)CSc1n[nH]/c(=N\C(=O)CCc2ccccc2)/s1

STK593756
Synonyms: 2',6'-dihydroxy-2,4-dimethyl-1,2,4,4a-tetrahydro-4'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidin]-4'-one
Smiles: CC1OC(C)C2N(C1)c1ccccc1CC12C(=NC(=NC1=O)O)O

STK593757
Synonyms: N-[(1Z)-1-{1-cyano-2-[(furan-2-ylmethyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]furan-2-carboxamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccco1)/C(=O)NCc1ccco1

STK593758
Synonyms: 5-bromo-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N,3-dimethyl-1H-indole-2-carboxamide
Smiles: Brc1ccc2c(c1)c(C)c([nH]2)C(=O)N(C1CCS(=O)(=O)C1)C

STK593759
Synonyms: N-(2-chloro-4,6-dimethylphenyl)-2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2c(C)cc(cc2Cl)C)nnc1COc1ccc(cc1)Cl

STK593761
Synonyms: N-[(2E)-3-(3-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-phenylpropanamide
Smiles: COc1cccc(c1)CN1/C(=N\C(=O)CCc2ccccc2)/SC2C1CS(=O)(=O)C2

STK593762
Synonyms: N-[(2Z)-1,3-benzoxazol-2(3H)-ylidene]-5-(2-methylcyclohexyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: CC1CCCCC1N1CNC(=NC1)/N=c/1\oc2c([nH]1)cccc2

STK593763
Synonyms: 2-(benzylsulfanyl)-9-(2-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccccc1C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1ccccc1

STK593765
Synonyms: (4E)-4-[(4-bromophenyl)(hydroxy)methylidene]-5-(4-fluorophenyl)-1-(2-hydroxyethyl)pyrrolidine-2,3-dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Br)/O)/C1c1ccc(cc1)F

STK593767
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2,4-dimethoxyphenyl)carbonyl]-2'-[(3-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)OC)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccc(c1)OC)C(=O)Nc1c2cccc1)cccc3

STK593770
Synonyms: 7-[(4-chlorobenzyl)sulfanyl]-12-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Smiles: CC1CCc2c(C1)c1c(s2)n2c(SCc3ccc(cc3)Cl)nnc2n2c1ncn2

STK593771
Synonyms: 2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-3-ylmethyl)acetamide
Smiles: O=C(NCc1cccnc1)COc1ccc2c(c1C)oc(=O)cc2C

STK593772
Synonyms: 1',3',10-trimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H,7H-spiro[pyrido[1',2':1,2]pyrimido[5,4-c]quinolizine-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)N2CCCCC2C2(C1)C(=O)N(C)C(=O)N(C2=O)C

STK593773
Synonyms: 2-(8,8,10,10-tetramethyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline
Smiles: Nc1ccccc1c1nc2n(n1)cnc1c2c2CC(C)(C)NC(c2s1)(C)C

STK593776
Synonyms: (1'S,3R,3'S,7a'S)-5''-chloro-1'-[(2,4-dichlorophenyl)carbonyl]-7''-methyl-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Clc1ccc(c(c1)Cl)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(Cl)cc1C

STK593777
Synonyms: 3-[2-(methylsulfanyl)phenyl]tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-imine5,5-dioxide
Smiles: CSc1ccccc1N1C(=N)SC2C1CS(=O)(=O)C2

STK593781
Synonyms: N-[(2Z)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-ylidene]-3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanamide
Smiles: Clc1ccc(cc1)c1cs/c(=N\C(=O)CCn2c(=O)sc3c2cccc3)/[nH]1

STK593782
Synonyms: N-[(2E)-3-[4-(dimethylamino)phenyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(3-methylphenyl)acetamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccc(cc1)N(C)C)CS(=O)(=O)C2)Cc1cccc(c1)C

STK593783
Synonyms: 4-methyl-N-(tetrazolo[1,5-a]quinoxalin-4-yl)benzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1nc2ccccc2n2c1nnn2

STK593787
Synonyms: ethyl4-[({(2E)-4-hydroxy-2-[(4-methoxyphenyl)imino]-2,5-dihydro-1,3-thiazol-5-yl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CC1S/C(=N/c2ccc(cc2)OC)/N=C1O

STK593789
Synonyms: 8-(butan-2-yl)-4-hydroxy-1,6,7-trimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: CCC(n1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C)C

STK593790
Synonyms: N-(3-chloro-4-methylphenyl)-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)C)nc2c(c1=O)cccc2

STK593791
Synonyms: 2-{4-[(1-butyl-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}ethanol
Smiles: CCCCn1c(CN2CCN(CC2)CCO)nc2c1cccc2

STK593793
Synonyms: 1,3-dimethyl-7-(naphthalen-1-ylmethyl)-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1n(C)c2nc(n(c2c(=O)n1C)Cc1cccc2c1cccc2)CN1CCN(CC1)c1ccccc1

STK593794
Synonyms: 1-(1',3'-dimethyl-2',4',6'-trioxo-1,1',2,3',4,4',4a,6'-octahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidin]-8-yl)-3-methylthiourea
Smiles: CNC(=S)Nc1ccc2c(c1)CC1(C3N2CCOC3)C(=O)N(C)C(=O)N(C1=O)C

STK593795
Synonyms: 2-(1,3-benzoxazol-2-ylamino)-4-(3-hydroxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5-ol
Smiles: Oc1cccc(c1)C1N=C(Nc2nc3c(o2)cccc3)N=C2C1=C(O)CC(C2)(C)C

STK593797
Synonyms: (8S,8aR,11aS)-N-(1,3-benzodioxol-5-yl)-9,11-dioxo-10-phenyl-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Smiles: O=C([C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3)Nc1ccc2c(c1)OCO2

STK593799
Synonyms: 8-ethoxy-N-(3-methoxypropyl)-5H-pyrimido[5,4-b]indol-4-amine
Smiles: COCCCNc1ncnc2c1[nH]c1c2cc(cc1)OCC

STK593800
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1cccc(c1)C(F)(F)F

STK593801
Synonyms: 7-chloro-1',3'-diethyl-3-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCN1C(=O)N(CC)C(=O)C2(C1=O)Cc1c(Cl)cccc1N1C2CN(C)CC1

STK593802
Synonyms: (3R)-N-[2-(cyclohex-1-en-1-yl)ethyl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C1c2ccccc2C2N1[C@H](C(=O)NCCC1=CCCCC1)C(S2)(C)C

STK593803
Synonyms: (2Z)-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2-[(2E)-3-phenylprop-2-en-1-ylidene]-2,3-dihydro-1-benzofuran-6-olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\C=C\c1ccccc1)/C2=O

STK593804
Synonyms: 1-({3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]phenyl}carbonyl)-L-proline
Smiles: O=C(N1CCC[C@H]1C(=O)O)c1cccc(c1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK593806
Synonyms: 3-{[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]amino}-6,7-dimethoxy-2-benzofuran-1(3H)-one
Smiles: COc1c(OC)ccc2c1C(=O)OC2Nc1scc(n1)c1ccc(cc1)C1CCCCC1

STK593808
Synonyms: 1-(4-chlorophenyl)-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593809
Synonyms: (4E)-1-(furan-2-ylmethyl)-4-[hydroxy(3-nitrophenyl)methylidene]-5-(2-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccccc1C1/C(=C(/c2cccc(c2)[N+](=O)[O-])\O)/C(=O)C(=O)N1Cc1ccco1

STK593810
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK593811
Synonyms: methyl4-[({[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)OC)nnc1c1ccccc1Cl

STK593812
Synonyms: N'-[2-(6-bromo-2-methoxynaphthalen-1-yl)acetyl]pyridine-2-carbohydrazide
Smiles: COc1ccc2c(c1CC(=O)NNC(=O)c1ccccn1)ccc(c2)Br

STK593813
Synonyms: 9-methoxy-6-(3-nitrobenzyl)-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2Cc1cccc(c1)[N+](=O)[O-]

STK593814
Synonyms: (2Z)-2-(3-methylbenzylidene)-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: Cc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]

STK593815
Synonyms: 2-[(2-chlorobenzyl)sulfanyl]-5-hydroxy-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(SCc2ccccc2Cl)N=C2C(=C(O)CCC2)C1c1cc(OC)c(c(c1)OC)OC

STK593816
Synonyms: (4Z)-2-(4-chlorophenyl)-4-[2-(3,4-dimethoxyphenyl)-4H-chromen-4-ylidene]-1,3-oxazol-5(4H)-one
Smiles: COc1cc(ccc1OC)C1=C/C(=C\2/N=C(OC2=O)c2ccc(cc2)Cl)/c2c(O1)cccc2

STK593817
Synonyms: N-(2-fluorophenyl)-2-{[5-(2-fluorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2F)nnc1c1ccccc1F

STK593818
Synonyms: propyl[(3,4-dimethoxyphenyl)(phenylamino)methyl][4-(dimethylamino)phenyl]phosphinate
Smiles: CCCOP(=O)(C(c1ccc(c(c1)OC)OC)Nc1ccccc1)c1ccc(cc1)N(C)C

STK593819
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]acetamide
Smiles: O=C(NC1CCS(=O)(=O)C1)COc1cc(C)cc2c1c1CCCc1c(=O)o2

STK593820
Synonyms: N-{[trans-4-({[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}methyl)cyclohexyl]carbonyl}-beta-alanine
Smiles: O=C(CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C)NC[C@@H]1CC[C@H](CC1)C(=O)NCCC(=O)O

STK593821
Synonyms: N-[(1Z)-1-{1-cyano-2-[(4-methylbenzyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-4-methylbenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C)/C(=O)NCc1ccc(cc1)C

STK593822
Synonyms: 7-(4-fluorobenzyl)-6-hydroxy-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)F)c(O)nc(=O)n2C

STK593823
Synonyms: N-(2,5-dimethoxybenzyl)-5-fluoro-N-(prop-2-en-1-yl)-1H-indole-2-carboxamide
Smiles: C=CCN(C(=O)c1cc2c([nH]1)ccc(c2)F)Cc1cc(OC)ccc1OC

STK593824
Synonyms: 2'-hydroxy-1',13-dimethyl-1,2,3,4,5,5a-hexahydro-4'H,7H,8H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2-a]azepine-6,5'-pyrimidine]-4',6',8(1'H)-trione
Smiles: OC1=NC(=O)C2(C(=O)N1C)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C

STK593825
Synonyms: 2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1c1ccccc1)c1cnccn1

STK593826
Synonyms: 8-[benzyl(methyl)amino]-6-hydroxy-3-methyl-7-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}-3,7-dihydro-2H-purin-2-one
Smiles: O=c1nc(O)c2c(n1C)nc(n2CCCSc1nnnn1c1ccccc1)N(Cc1ccccc1)C

STK593829
Synonyms: N-(furan-2-ylmethyl)-2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CC(Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCc1ccco1)C

STK593830
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-ethylphenyl)-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nccs1

STK593835
Synonyms: 10-methyl-2,3-diphenylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: O=c1n(c2ccccc2)c(nc2c1c(=O)c1ccccc1n2C)c1ccccc1

STK593836
Synonyms: 2-[(3a'S,6a'R)-7-chloro-5'-(2-chlorobenzyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: NC(=O)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cccc1Cl

STK593838
Synonyms: 2-{[3-cyano-5-hydroxy-4-(4-methoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: COc1ccc(cc1)C1C(=C(SCC(=O)N(c2ccccc2)c2ccccc2)N=C2C1=C(O)CC(C2)(C)C)C#N

STK593839
Synonyms: N-{[trans-4-({[(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]amino}methyl)cyclohexyl]carbonyl}-beta-alanine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C)NC[C@@H]1CC[C@H](CC1)C(=O)NCCC(=O)O

STK593840
Synonyms: 3-{[4-(morpholin-4-ylcarbonyl)cyclohexyl]methyl}quinazolin-4(3H)-one
Smiles: O=C(N1CCOCC1)C1CCC(CC1)Cn1cnc2c(c1=O)cccc2

STK593841
Synonyms: 2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK593842
Synonyms: N-(2,3-dihydroimidazo[2,1-b][1,3]benzothiazol-6-yl)-4,5,6-trimethoxy-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)Nc1ccc2c(c1)n1CCN=c1s2

STK593843
Synonyms: (5E)-3-(4-bromophenyl)-6-hydroxy-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: Brc1ccc(cc1)N1C(=O)N=C(/C(=C\NCCCn2cncc2)/C1=O)O

STK593845
Synonyms: N-[(2Z)-3-(4-bromo-2-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: Brc1ccc(c(c1)Cl)N1/C(=N/C(=O)C)/SC2C1CS(=O)(=O)C2

STK593846
Synonyms: ethyl4-{(3E)-2-(4-bromophenyl)-3-[(4-chlorophenyl)(hydroxy)methylidene]-4,5-dioxopyrrolidin-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(c2ccc(cc2)Br)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STK593848
Synonyms: N-(4-chlorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Smiles: COc1cc2CN(CCc2cc1OC)C(=S)Nc1ccc(cc1)Cl

STK593849
Synonyms: N-(3-chloro-4-fluorophenyl)-6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]hexanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK593850
Synonyms: (3S,3a'R,8a'S,8b'S)-7-chloro-2'-(2-methylphenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2ccccc2C)C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1cccc2Cl

STK593851
Synonyms: N-[4-(diethylamino)phenyl]-2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C)CC

STK593852
Synonyms: tert-butyl(3S)-3-({2-[(3-methylphenyl)amino]-2-oxoethyl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: O=C(Nc1cccc(c1)C)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK593854
Synonyms: 7-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-8-(dimethylamino)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CN(c1nc2c(n1CCSc1nc3c(o1)cccc3)c(O)nc(=O)n2C)C

STK593855
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)nnc1COc1ccc(cc1)Cl

STK593856
Synonyms: 3-(2-methylpropyl)-2-(4-nitrophenyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: CC(Cn1c(nc2c(c1=O)c(=O)c1c(s2)cccc1)c1ccc(cc1)[N+](=O)[O-])C

STK593857
Synonyms: N-[(2Z)-5-{[2-(naphthalen-2-yl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: CC(=O)/N=c\1/[nH]nc(s1)SCC(=O)c1ccc2c(c1)cccc2

STK593858
Synonyms: ethyl1-[4-(diethylamino)phenyl]-5-ethoxy-2-methyl-1H-benzo[g]indole-3-carboxylate
Smiles: CCOC(=O)c1c2cc(OCC)c3c(c2n(c1C)c1ccc(cc1)N(CC)CC)cccc3

STK593860
Synonyms: 1-(4-ethoxyphenyl)-4-(4-methoxyphenyl)-N-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccc(cc1)C)cc3c1ccc(cc1)OC

STK593864
Synonyms: 2-methyl-N-[6-methyl-2-(4-methylphenyl)-5-oxo-4-phenyl-2,5-dihydropyridazin-3-yl]benzamide
Smiles: Cc1ccc(cc1)n1nc(C)c(=O)c(c1NC(=O)c1ccccc1C)c1ccccc1

STK593867
Synonyms: 3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,2,3-benzotriazin-4(3H)-one
Smiles: CN1CCN(CC1)C(=O)Cn1nnc2c(c1=O)cccc2

STK593871
Synonyms: 2-{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2cccc(c2)C)c2c(n1)CC(OC2)(C)C

STK593872
Synonyms: 5-(4-chlorophenyl)-1,3,7,7-tetramethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Clc1ccc(cc1)c1c2c(=O)n(C)c(=O)n(c2c2n1C(C)(C)COC2)C

STK593874
Synonyms: N-cyclopentyl-4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NC1CCCC1

STK593875
Synonyms: 6-chloro-3,4-dimethyl-9-(pyridin-2-yl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: Clc1cc2c(c3c1OCN(C3)c1ccccn1)oc(=O)c(c2C)C

STK593876
Synonyms: N-(2,5-dimethylphenyl)-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]furan-2-carboxamide
Smiles: Cc1ccc(c(c1)N(C(=O)c1ccco1)Cc1cc2ccc(cc2[nH]c1=O)C)C

STK593879
Synonyms: 3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-ylN-[(4-methylphenyl)sulfonyl]-L-valinate
Smiles: CC([C@@H](C(=O)Oc1cc(C)cc2c1c1CCCCc1c(=O)o2)NS(=O)(=O)c1ccc(cc1)C)C

STK593880
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(4-methoxyphenyl)-5-phenylpyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccccc1

STK593882
Synonyms: 3-cyclohexyl-N-[4-(propan-2-yloxy)benzyl]-3-[4-(propan-2-yloxy)phenyl]propan-1-amine
Smiles: CC(Oc1ccc(cc1)CNCCC(c1ccc(cc1)OC(C)C)C1CCCCC1)C

STK593883
Synonyms: N-benzyl-N-ethyl-4,5,6-trimethoxy-1H-indole-2-carboxamide
Smiles: CCN(C(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC)Cc1ccccc1

STK593884
Synonyms: pentyl{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)OC

STK593885
Synonyms: 4-[(E)-(7-iminio-2-methyl-5-oxo-5H-[1,2]oxazolo[2,3-a]pyrimidin-6(7H)-ylidene)methyl]phenolate
Smiles: [O-]c1ccc(cc1)/C=C\1/C(=O)N=c2n(C1=[NH2+])oc(c2)C

STK593886
Synonyms: N-(3,4-difluorophenyl)-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)F)nnc1COc1ccccc1

STK593887
Synonyms: 6-chloro-5-methyl-2-[(3-nitrobenzyl)amino][1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: [O-][N+](=O)c1cccc(c1)CNc1nn2c(n1)nc(c(c2O)Cl)C

STK593888
Synonyms: N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)pyridine-4-carboxamide
Smiles: O=C(c1ccncc1)N(Cc1cc2cccc(c2[nH]c1=O)C)CC1CCCO1

STK593889
Synonyms: 2-amino-1-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1OC)OC

STK593890
Synonyms: 2-{[6-cyano-8,8-dimethyl-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}-N-(2-nitrophenyl)acetamide
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCC(=O)Nc3ccccc3[N+](=O)[O-])nnc2c2c1CC(C)(C)OC2

STK593891
Synonyms: 7-(4-fluorobenzyl)-1,3-dimethyl-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)Cn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK593895
Synonyms: N-(3-chlorophenyl)-2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)Cl)nnc1c1cccc(c1)Cl

STK593897
Synonyms: 3-(4-methylphenyl)-7-phenyl-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: Cc1ccc(cc1)C1=NOC2(C1)CC(=O)N(C2=O)c1ccccc1

STK593898
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2,5-dichlorophenyl)-7-ethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(Cl)ccc1Cl

STK593899
Synonyms: N-(3-methoxypropyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: COCCCNC(=O)c1nn2c(n1)nc(cc2C)C

STK593900
Synonyms: (4E)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-5-(4-methoxyphenyl)-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1c1nnc(s1)SC

STK593901
Synonyms: 1',6'-dimethyl-1,3-bis(4-methylphenyl)-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: Cc1ccc(cc1)N1C(=O)N(c2ccc(cc2)C)C(=O)C2(C1=O)CN(C)c1c(C2)cc(cc1)C

STK593903
Synonyms: (4Z)-N-(2-chlorophenyl)-4-(hydroxyimino)-3,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: O/N=C\1/CC(C)(C)Cc2c1c(C)c(o2)C(=O)Nc1ccccc1Cl

STK593904
Synonyms: (4E)-1-(3-chloro-4-methylphenyl)-5-(2,5-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: COc1ccc(c(c1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(c(c1)Cl)C)OC

STK593905
Synonyms: 3-(1,3-benzodioxol-5-ylmethyl)-1'-tert-butyl-2'-hydroxy-8-nitro-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: OC1=NC(=O)C2(C(=O)N1C(C)(C)C)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-]

STK593906
Synonyms: 3-(2-methoxyethyl)-1-methyl-8-(2-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C

STK593908
Synonyms: 8-(4-benzylpiperidin-1-yl)-7-(4-fluorobenzyl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Fc1ccc(cc1)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)Cc1ccccc1

STK593912
Synonyms: N-(3,4-dichlorophenyl)-1-(4-ethoxyphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)Nc2ccc(c(c2)Cl)Cl)n2c3c1CCCCn3c(c2)c1ccccc1

STK593914
Synonyms: 4-[(2E)-2-(2-chloro-6-fluorobenzylidene)hydrazinyl]-5-(4-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1N/N=C/c1c(F)cccc1Cl

STK593915
Synonyms: 3-(4-methylphenyl)-4-(4-nitrophenyl)-5-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: Cc1ccc(cc1)c1[nH]nc2c1C(c1ccc(cc1)[N+](=O)[O-])N(C2=O)c1ccccc1

STK593916
Synonyms: 3-(3-chlorobenzyl)-4-methylpyrimido[1,2-a]benzimidazol-2-ol
Smiles: Clc1cccc(c1)Cc1c(O)nc2n(c1C)c1ccccc1n2

STK593917
Synonyms: 1-(4-methoxyphenyl)-N-[(2S)-3-methyl-1-oxo-1-(piperidin-1-yl)butan-2-yl]-5-oxopyrrolidine-3-carboxamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)N1CCCCC1)C(C)C

STK593918
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-(3-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)c1ccccc1

STK593924
Synonyms: ethyl4-[1-methyl-3-(2-methylprop-2-en-1-yl)-2,4-dioxo-1,2,3,4,6,7-hexahydro-8H-imidazo[2,1-f]purin-8-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC(=C)C

STK593925
Synonyms: 3-[(2,4-dichlorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)OCc1nnc(n1Cc1ccco1)SCc1ccc(cc1Cl)Cl

STK593926
Synonyms: 3-(3-chlorophenyl)-2-[(3-ethoxypropyl)amino]-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCOCCCNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C

STK593927
Synonyms: N-(3-fluorophenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1cccc(c1)F

STK593928
Synonyms: N-(2-methoxyethyl)-5,10-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: COCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)CC2

STK593929
Synonyms: 2-{[4-(2-fluorophenyl)piperazin-1-yl]carbonyl}-3,6,6-trimethyl-6,7-dihydro-1-benzofuran-4(5H)-one
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)N1CCN(CC1)c1ccccc1F

STK593930
Synonyms: 4-[(3a'S,6a'R)-7-chloro-3'-(3,4-dihydroxybenzyl)-5-methyl-2,4',6'-trioxo-1,2,2',3',3a',4',6',6a'-octahydro-5'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cc(C)cc2Cl

STK593931
Synonyms: 2-({6-cyano-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)-N-(naphthalen-2-yl)acetamide
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)Nc3ccc4c(c3)cccc4)nnc2c2c1CC(C)(C)OC2

STK593933
Synonyms: 3-chloro-4-[(4-iodophenyl)amino]-1-(naphthalen-1-yl)-1H-pyrrole-2,5-dione
Smiles: Ic1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)c1cccc2c1cccc2

STK593934
Synonyms: 5-(4-ethoxyphenyl)-4-{[(E)-(3-methylphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)C

STK593935
Synonyms: 2-phenyl-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-ol
Smiles: Oc1c2CCCc2nc2n1nc(n2)c1ccccc1

STK593937
Synonyms: 2-{benzyl[(10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl]amino}ethanol
Smiles: OCCN(Cc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2)Cc1ccccc1

STK593938
Synonyms: N-(2,6-dimethylphenyl)-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK593939
Synonyms: N-(2-tert-butylphenyl)-2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C(C)(C)C)CSc1nnc(n1C)c1cccc(c1)Cl

STK593940
Synonyms: 2-{[4-(4-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(dimethylamino)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)N(C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C

STK593941
Synonyms: N-[(2Z)-3-(2-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: COc1ccccc1N1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK593942
Synonyms: (2'S,3S,3'S,10b'R)-3'-(phenylcarbonyl)-2'-[(3,4,5-trimethoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cc(cc(c1OC)OC)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK593944
Synonyms: 2-{[4-(4-chlorophenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethylphenyl)acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK593945
Synonyms: 5-(4-fluorophenyl)-4-{[(E)-1H-indol-3-ylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1c[nH]c2c1cccc2

STK593946
Synonyms: 3-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-4-amine
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCc1ccc(cc1)[N+](=O)[O-]

STK593948
Synonyms: 2-(6-ethoxy-1,3-benzothiazol-2-yl)-1-[3-(prop-2-en-1-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: C=CCOc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)OCC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593950
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]acetamide
Smiles: O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)COc1cc(C)cc2c1c1CCCc1c(=O)o2

STK593951
Synonyms: (5E)-5-{1-[(3-fluorophenyl)amino]propylidene}-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/Nc1cccc(c1)F

STK593952
Synonyms: N'-[(E)-furan-2-ylmethylidene]-5-[2-(naphthalen-1-ylmethoxy)phenyl]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccccc1OCc1cccc2c1cccc2)N/N=C/c1ccco1

STK593954
Synonyms: 5-(2-chloro-5-nitrophenyl)-4-hydroxy-1,3-dimethyl-3,5-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,6-dione
Smiles: Clc1ccc(cc1C1C2=C(N=c3c1c(O)n(C)c(=O)n3C)c1c(C2=O)cccc1)[N+](=O)[O-]

STK593955
Synonyms: N-(2,4-dichlorophenyl)-6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)hexanamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CCCCCn1nnc2c(c1=O)cccc2

STK593956
Synonyms: 2-(2-methoxyethyl)-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COCCN1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)cccc1

STK593957
Synonyms: 10-(2,4-dimethoxyphenyl)-1,3-dimethyl-5-phenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: COc1ccc(c(c1)OC)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C

STK593959
Synonyms: N-(furan-2-ylmethyl)-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: O=C(c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2)NCc1ccco1

STK593960
Synonyms: (2Z)-N-(2-methylbenzyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanamide
Smiles: O=C(/C=C/1\NCCc2c1cc1OCCCOc1c2)NCc1ccccc1C

STK593961
Synonyms: N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-6-fluoro-2-methylquinoline-4-carboxamide
Smiles: Cc1nc2ccc(cc2c(c1)C(=O)/N=c/1\sc2c([nH]1)cccc2)F

STK593963
Synonyms: 9-(3-chlorophenyl)-2-(ethylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1cccc(c1)Cl

STK593964
Synonyms: 5-(3,4,5-trimethoxyphenyl)-4-{[(E)-(2,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(OC)c(cc1/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC)OC

STK593966
Synonyms: morpholin-4-yl{4-[3-(trifluoromethyl)-4,5-dihydro-1H-furo[2,3-g]indazol-1-yl]phenyl}methanone
Smiles: O=C(c1ccc(cc1)n1nc(c2c1c1ccoc1CC2)C(F)(F)F)N1CCOCC1

STK593967
Synonyms: (E)-{2-[4-(dimethylamino)phenyl]-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-fluorophenyl)methanolate
Smiles: Fc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)N(C)C)N(C(=O)C1=O)CCC[NH+]1CCOCC1)/[O-]

STK593969
Synonyms: methylN-[(4-methylphenyl)carbamoyl]-L-methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)Nc1ccc(cc1)C

STK593972
Synonyms: N-benzyl-2-{[10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)NCc1ccccc1)nn2)CC(OC3)(C)C

STK593975
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4-difluorophenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1F)F

STK593976
Synonyms: N,4-bis(4-methylphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1c(c2ccccc2)c2c3n1cc(n3CCCC2)c1ccc(cc1)C

STK593977
Synonyms: N-(2,3-dichlorophenyl)-3,3-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C1)C(C2=O)(C)C)Nc1cccc(c1Cl)Cl

STK593979
Synonyms: (2E)-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-3-(3,4-dimethoxyphenyl)prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)/N=c\2/sc3c([nH]2)cccc3)ccc1OC

STK593982
Synonyms: N-(7-methoxy-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-1-yl)propanamide
Smiles: CCC(=O)NN1CCc2c1nc1cc(OC)ccc1c2

STK593983
Synonyms: 2-{5-[(2,6-dichlorobenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cc1ccc(cc1)n1c(SCc2c(Cl)cccc2Cl)nnc1c1ccccn1

STK593984
Synonyms: 2-chloro-4-{(Z)-[2-(3-iodophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-6-methoxyphenylacetate
Smiles: COc1cc(/C=C/2\N=C(OC2=O)c2cccc(c2)I)cc(c1OC(=O)C)Cl

STK593986
Synonyms: N-(2-chlorophenyl)-1-(4-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1Cl)cc3c1ccc(cc1)C

STK593987
Synonyms: 4-[4-(5-fluoro-2-methoxybenzyl)piperazin-1-yl]-2,8,10-trimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1CN1CCN(CC1)c1cc(C)nc2n1nc1c2c(C)cc(n1)C)F

STK593988
Synonyms: N-(4-bromophenyl)-2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK593990
Synonyms: N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanamide
Smiles: O=C(CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NCCC1=CCCCC1

STK593991
Synonyms: 8-[4-(2-chlorobenzyl)piperazin-1-yl]-7-ethyl-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1Cl

STK593992
Synonyms: (E)-1-benzofuran-2-yl{1'-[3-(dimethylammonio)propyl]-1-methyl-2,4',5'-trioxo-1,2-dihydro-3'H-spiro[indole-3,2'-pyrrolidin]-3'-ylidene}methanolate
Smiles: C[NH+](CCCN1C(=O)C(=O)/C(=C(\c2cc3c(o2)cccc3)/[O-])/C21c1ccccc1N(C2=O)C)C

STK593993
Synonyms: 3-(4-methoxyphenyl)-4-phenyl-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)c1nnc(n1c1ccccc1)SC/C=C/c1ccccc1

STK593994
Synonyms: 7,7-dimethyl-2-(3-methylphenyl)-4-[(2-methylprop-2-en-1-yl)sulfanyl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: CC(=C)CSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C

STK593996
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(4-hydroxy-3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(ccc1O)C1N(c2nc3c(s2)cc(cc3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593997
Synonyms: N-butyl-4-methyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: CCCCN(S(=O)(=O)c1ccc(cc1)C)Cc1cc2cccc(c2[nH]c1=O)C

STK593998
Synonyms: 2-chloro-N-(2,3-dimethylphenyl)-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: Cc1c(C)cccc1N(C(=O)c1ccccc1Cl)Cc1cc2cccc(c2[nH]c1=O)C

STK593999
Synonyms: 2-(3,4-dimethoxyphenyl)-N-[(2Z)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: COc1ccc(cc1OC)CC(=O)/N=C/1\SC2C(N1c1ccccc1)CS(=O)(=O)C2

STK594000
Synonyms: methyl4-{(3E)-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-4,5-dioxopyrrolidin-2-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK594001
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(diethylamino)phenyl]acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl)CC

STK594003
Synonyms: 5-{2-[(2-chlorobenzyl)oxy]phenyl}-N'-[(E)-(4-methoxyphenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1n[nH]c(c1)c1ccccc1OCc1ccccc1Cl

STK594004
Synonyms: 8-(4-fluorophenyl)-4-hydroxy-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Fc1ccc(cc1)n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK594008
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-chloro-2-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK594009
Synonyms: (5E)-5-{[1-(3,4-dichlorobenzyl)-1H-indol-3-yl]methylidene}-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\c2cn(c3c2cccc3)Cc2ccc(c(c2)Cl)Cl)/C(=O)N1Cc1ccco1

STK594010
Synonyms: N-(2-chlorophenyl)-4-(4-chlorophenyl)-1-(4-ethoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1Cl)cc3c1ccc(cc1)Cl

STK594011
Synonyms: 5,10,10-trimethyl-N-[3-(morpholin-4-yl)propyl]-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: O=C(c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2)NCCCN1CCOCC1

STK594014
Synonyms: 2-phenyl-1,10b-dihydro-2'H-spiro[pyrazolo[1,5-c][1,3]benzoxazine-5,4'-[1,3]thiazinane]-2'-thione
Smiles: S=C1SCCC2(N1)Oc1ccccc1C1N2N=C(C1)c1ccccc1

STK594015
Synonyms: 8-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: O=S(=O)(c1ccc2c(c1)OCCO2)N1CCc2c(C1)cc1c(c2)OCCCO1

STK594016
Synonyms: 5-{[4-(diethylammonio)benzyl]amino}-2-(morpholin-4-yl)benzoate
Smiles: CC[NH+](c1ccc(cc1)CNc1ccc(c(c1)C(=O)[O-])N1CCOCC1)CC

STK594018
Synonyms: 5-{5-[(3-fluorobenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}pentan-1-amine
Smiles: NCCCCCc1nnc(o1)S(=O)(=O)Cc1cccc(c1)F

STK594019
Synonyms: 7-chloro-2-(6-methoxy-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)OC)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK594020
Synonyms: (2'S,3R,3'S,7a'S)-7''-ethyl-2'-[(4-fluorophenyl)carbonyl]-5',6',7',7a'-tetrahydrodispiro[indole-3,1'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@]2([C@@H]1C(=O)c1ccc(cc1)F)C(=O)Nc1c2cccc1

STK594021
Synonyms: N-[(3-amino-6-ethyl-5-methylthieno[2,3-b]pyridin-2-yl)carbonyl]glycine
Smiles: CCc1nc2sc(c(c2cc1C)N)C(=O)NCC(=O)O

STK594022
Synonyms: 4-({[(3S)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]carbonyl}amino)butanoicacid
Smiles: OC(=O)CCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK594023
Synonyms: 1-(4-fluorophenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: Fc1ccc(cc1)C(=O)CSc1nnc(n1c1ccccc1)c1ccccn1

STK594025
Synonyms: (4-bromophenyl)(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)c1ccc(cc1)Br

STK594026
Synonyms: 2-({5-[(4-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide
Smiles: Cc1ccc(cc1)OCc1nnc(n1c1ccccc1)SCC(=O)Nc1c(C)cc(cc1C)C

STK594027
Synonyms: 9-methyl-2-[3-(propan-2-yloxy)phenyl]-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1cccc(c1)OC(C)C

STK594028
Synonyms: 1-fluoro-1',3'-dimethyl-6a,7,8,9,10,11-hexahydro-2'H,5H-spiro[azepino[1,2-a]quinoline-6,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1cccc(c1N1C2CCCCC1)F

STK594030
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-fluorophenyl)carbonyl]-2'-[(4-propoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK594031
Synonyms: (4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-methyl-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])C)/O

STK594032
Synonyms: 4-{[(E)-(4-tert-butylphenyl)methylidene]amino}-5-(3-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)(C)C

STK594033
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2-methoxyphenyl)carbonyl]-2'-[(3-propoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCOc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK594036
Synonyms: 2-({4-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dimethylphenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)C)C)nnc1COc1ccc(cc1)C

STK594037
Synonyms: 3-[(3,4-dichlorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)OCc1nnc(n1Cc1ccco1)SCc1ccc(c(c1)Cl)Cl

STK594038
Synonyms: N-[(1Z)-1-{1-cyano-2-[(3-methylbutyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-3,4,5-trimethoxybenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cc(OC)c(c(c1)OC)OC)/C(=O)NCCC(C)C

STK594039
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2-chlorophenyl)carbonyl]-2'-[(4-nitrophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Clc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3

STK594041
Synonyms: N-[(2E)-5,5-dioxido-3-[4-(propan-2-yl)phenyl]tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-methylbutanamide
Smiles: CC(CC(=O)/N=C\1/SC2C(N1c1ccc(cc1)C(C)C)CS(=O)(=O)C2)C

STK594042
Synonyms: {[(4-fluorophenyl)amino][(2-oxo-2-phenylethyl)sulfanyl]methylidene}propanedinitrile
Smiles: N#CC(=C(Nc1ccc(cc1)F)SCC(=O)c1ccccc1)C#N

STK594043
Synonyms: 2-chloro-N-[(1Z)-1-{1-cyano-2-[(2-methylpropyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1Cl)/C(=O)NCC(C)C

STK594044
Synonyms: (3E)-3-(3,4-dimethoxybenzylidene)-4-imino-7,8-dimethyl-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one
Smiles: COc1cc(ccc1OC)/C=C\1/C(=O)N=c2n(C1=N)c1cc(C)c(cc1s2)C

STK594045
Synonyms: 3-[(4-bromobenzyl)sulfanyl]-5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(COc2ccc(cc2)Cl)nnc1SCc1ccc(cc1)Br

STK594048
Synonyms: (1S)-1-{5-[(2,5-dimethylbenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}-3-(methylsulfanyl)propan-1-amine
Smiles: CSCC[C@@H](c1nnc(o1)SCc1cc(C)ccc1C)N

STK594049
Synonyms: 6-methyl-9-[3-(trifluoromethyl)phenyl]-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c2c1CCC2)c1cccc(c1)C(F)(F)F

STK594050
Synonyms: 1-(3-chlorophenyl)-4-[4-(methylsulfanyl)phenyl]-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: CSc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)Cl

STK594051
Synonyms: N-[(3Z)-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]thiophene-2-carboxamide
Smiles: CC(Cn1[nH]/c(=N\C(=O)c2cccs2)/c2c1nc1ccccc1c2)C

STK594052
Synonyms: (3R,3'S,5'S)-N-(2,5-dimethoxyphenyl)-5-fluoro-5'-(2-methylpropyl)-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(F)cc1)CC(C)C)OC

STK594053
Synonyms: 3-benzyl-10-methyl-2-propylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCc1nc2c(c(=O)n1Cc1ccccc1)c(=O)c1c(n2C)cccc1

STK594054
Synonyms: 2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK594055
Synonyms: 2-[(3a'S,6a'R)-5'-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6,7-dimethyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: N#Cc1c(sc2c1CCCC2)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1ccc(c2C)C

STK594056
Synonyms: (4E)-1-(3-chloro-4-methylphenyl)-5-(4-chlorophenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(c(c1)Cl)C

STK594057
Synonyms: N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Smiles: CCN1CCCC1CNS(=O)(=O)c1ccc2c(c1)oc(=O)n2C

STK594058
Synonyms: 2-[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(2-methylpropyl)acetamide
Smiles: CC(CNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)F)C

STK594060
Synonyms: 7'-{(E)-[1-(4-fluorobenzyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trion
Smiles: Fc1ccc(cc1)CN1C(=O)N=C(/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK594061
Synonyms: 7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCN(CC1)Cc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C

STK594064
Synonyms: 4-[(2E)-2-(quinolin-4-ylmethylidene)hydrazinyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: N(=C\c1ccnc2c1cccc2)/Nc1ncnc2c1c1CCCCc1s2

STK594065
Synonyms: N-benzyl-4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-amine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCC2)ncnc3NCc1ccccc1)C

STK594066
Synonyms: (1'S,3R,3'S,7a'S)-6''-chloro-7''-methyl-1'-(thiophen-2-ylcarbonyl)-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Clc1ccc2c(c1C)NC(=O)[C@@]12N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccs1

STK594067
Synonyms: 2-(morpholin-4-ium-4-yl)-5-{[2-(trifluoromethyl)benzyl]amino}benzoate
Smiles: [O-]C(=O)c1cc(ccc1[NH+]1CCOCC1)NCc1ccccc1C(F)(F)F

STK594068
Synonyms: 1-amino-4-[(2-hydroxyethyl)amino]-2-(4-phenylpiperazin-1-yl)anthracene-9,10-dione
Smiles: OCCNc1cc(N2CCN(CC2)c2ccccc2)c(c2c1C(=O)c1ccccc1C2=O)N

STK594069
Synonyms: methylN-[(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)acetyl]-N-phenyl-beta-alaninate
Smiles: COC(=O)CCN(C(=O)CN1C(=O)c2c(S1(=O)=O)cccc2)c1ccccc1

STK594072
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(2-chlorophenyl)carbonyl]-3'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1Cl)C(=O)Nc1c2cccc1)cccc3)c1cccs1

STK594074
Synonyms: (4E)-1-benzyl-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])Cc1ccccc1)/c1ccc(cc1)[N+](=O)[O-]

STK594075
Synonyms: N-[2-(2-acetyl-4,5-dimethoxyphenyl)ethyl]-3-chloro-5-methoxy-4-propoxybenzamide
Smiles: CCCOc1c(Cl)cc(cc1OC)C(=O)NCCc1cc(OC)c(cc1C(=O)C)OC

STK594076
Synonyms: 2-hydroxy-1-(4-methoxyphenyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)C(C)C

STK594077
Synonyms: 2-{[5-(furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1Cc1ccco1)c1ccco1

STK594079
Synonyms: 4-[(4-acetylphenyl)amino]-1-methyl-3-nitroquinolin-2(1H)-one
Smiles: [O-][N+](=O)c1c(Nc2ccc(cc2)C(=O)C)c2ccccc2n(c1=O)C

STK594080
Synonyms: 3-[2-(cyclohex-1-en-1-yl)ethyl]-5-[(2E)-3-(4-ethoxyphenyl)prop-2-enoyl]-2,6-dihydroxypyrimidin-4(3H)-one
Smiles: CCOc1ccc(cc1)/C=C/C(=O)c1c(O)nc(n(c1=O)CCC1=CCCCC1)O

STK594081
Synonyms: (4E)-1-(4-ethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)N1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STK594082
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl[2-(2-fluorophenyl)-4,5-dioxo-1-(pyridinium-4-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: [O-]/C(=C\1/C(=O)C(=O)N(C1c1ccccc1F)Cc1cc[nH+]cc1)/c1ccc2c(c1)OCCO2

STK594086
Synonyms: ethyl4-[(6-benzyl-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl]-3-oxobutanoate
Smiles: CCOC(=O)CC(=O)CSc1c(Cc2ccccc2)c(C)nc2n1nc(c2c1ccccc1)C

STK594087
Synonyms: N-[4-(acetylamino)phenyl]-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CCn1nnc2c(c1=O)cccc2

STK594088
Synonyms: 6,7-dimethoxy-1-methyl-2-[(3-nitrophenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CCN(C(c2cc1OC)C)S(=O)(=O)c1cccc(c1)[N+](=O)[O-]

STK594090
Synonyms: methyl4-({2-[5-(acetylamino)-3-methyl-1H-pyrazol-1-yl]-1H-benzimidazol-1-yl}methyl)benzoate
Smiles: COC(=O)c1ccc(cc1)Cn1c(nc2c1cccc2)n1nc(cc1NC(=O)C)C

STK594091
Synonyms: 2-[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(propan-2-yl)acetamide
Smiles: CC(NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)F)C

STK594093
Synonyms: N-[4-(dimethylamino)phenyl]-2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1cccc(c1)C

STK594095
Synonyms: 5-(3-methoxyphenyl)-4-{[(E)-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1

STK594097
Synonyms: 5-(2-bromophenyl)-4-{[(E)-(4-hydroxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Oc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1Br

STK594098
Synonyms: N-[(2S)-1-(cyclopropylamino)-3-methyl-1-oxobutan-2-yl]-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: CC([C@@H](C(=O)NC1CC1)NC(=O)N1CCn2c1nc1c2cccc1)C

STK594099
Synonyms: (5E)-2-(3-bromophenyl)-5-(4-methoxybenzylidene)-3-(1,3-thiazol-2-yl)-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1ccc(cc1)/C=C\1/N=C(N(C1=O)c1nccs1)c1cccc(c1)Br

STK594100
Synonyms: N-(3-hydroxypropyl)-2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]propanamide
Smiles: OCCCNC(=O)C(Oc1cc(C)cc2c1c1CCCc1c(=O)o2)C

STK594103
Synonyms: 3-(5-{(E)-[2-hydroxy-1-(4-methylbenzyl)-5-oxo-1,5-dihydro-4H-imidazol-4-ylidene]methyl}furan-2-yl)-2-methylbenzoicacid
Smiles: Cc1ccc(cc1)CN1C(=N/C(=C/c2ccc(o2)c2cccc(c2C)C(=O)O)/C1=O)O

STK594106
Synonyms: 1-tert-butyl4-(4-butyl-8-methyl-2-oxo-2H-chromen-7-yl)piperidine-1,4-dicarboxylate
Smiles: CCCCc1cc(=O)oc2c1ccc(c2C)OC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK594112
Synonyms: [(3aR,4R,4aR,7aS,8R,8aR)-3-(3,4-dimethoxyphenyl)-5,7-dioxo-3a,4,4a,5,7,7a,8,8a-octahydro-6H-4,8-methano[1,2]oxazolo[4,5-f]isoindol-6-yl]aceticacid
Smiles: COc1cc(ccc1OC)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)CC(=O)O

STK594114
Synonyms: 2-chloro-N'-{(E)-[1-(4-fluorobenzyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}benzohydrazide
Smiles: Fc1ccc(cc1)CN1C(=O)N=C(/C(=C\NNC(=O)c2ccccc2Cl)/C1=O)O

STK594115
Synonyms: N-[(2Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-methylbutanamide
Smiles: COc1cc(CCN2/C(=N/C(=O)CC(C)C)/SC3C2CS(=O)(=O)C3)ccc1OC

STK594116
Synonyms: 2-{[4-(4-chlorophenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK594118
Synonyms: (5E)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-1-(butan-2-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCC(N1C(=NC(=O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C1=O)S)C

STK594120
Synonyms: (4Z)-6-[(4-benzylpiperazin-1-yl)methyl]-4-[(3-chloro-4-methylphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Nc1nc(CN2CCN(CC2)Cc2ccccc2)[nH]/c(=N/c2ccc(c(c2)Cl)C)/n1

STK594121
Synonyms: N-(2,6-dichlorophenyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Smiles: O=C(Nc1c(Cl)cccc1Cl)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK594122
Synonyms: ethyl2-amino-1-(2-{[(4-fluorophenyl)carbonyl]amino}ethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCNC(=O)c1ccc(cc1)F

STK594124
Synonyms: 8,8-dimethyl-4-(prop-2-en-1-ylsulfanyl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: C=CCSc1ncnc2c1oc1c2cc2c(n1)CC(OC2)(C)C

STK594125
Synonyms: (2S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: O=C([C@@H](n1cnc2c(c1=O)cccc2)C)Nc1cc(Cl)cc(c1)Cl

STK594126
Synonyms: 2-{[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl}-3,6,6-trimethyl-6,7-dihydro-1-benzofuran-4(5H)-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)c1oc2c(c1C)C(=O)CC(C2)(C)C

STK594128
Synonyms: 1'-benzyl-9-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[benzo[g]pyrido[1,2-a][1,8]naphthyridine-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: Cc1ccc2c(c1)cc1c(n2)N2CCCCC2C2(C1)C(=O)NC(=O)N(C2=O)Cc1ccccc1

STK594130
Synonyms: 8-[2-(3,4-dimethoxyphenyl)ethyl]-1,7-dimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cc(ccc1OC)CCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK594131
Synonyms: N-[3-(3,4-dichlorophenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]-3,4-dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1c(c2ccc(c(c2)Cl)Cl)c(=O)c2c(n1C)cccc2

STK594134
Synonyms: 5-(3,4-dichlorophenyl)-N'-[(1E)-1-(4-methylphenyl)ethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: Cc1ccc(cc1)/C(=N/NC(=O)c1n[nH]c(c1)c1ccc(c(c1)Cl)Cl)/C

STK594135
Synonyms: (1'S,3R,3'S,7a'S)-5''-chloro-1'-[(2-chlorophenyl)carbonyl]-7''-methyl-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Clc1cc(C)c2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccccc1Cl

STK594139
Synonyms: 3,5-bis(2-methylpropyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl3-methylbutanoate
Smiles: CC(CC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CC(C)C)cccc3)CC(C)C)C

STK594140
Synonyms: 7-[(4-bromobenzyl)sulfanyl]-11-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Smiles: CC1CCc2c(C1)sc1c2c2ncnn2c2n1c(SCc1ccc(cc1)Br)nn2

STK594142
Synonyms: (4Z)-2-(2-bromophenyl)-4-[4-(propan-2-yloxy)benzylidene]-4H-imidazol-5-ol
Smiles: CC(Oc1ccc(cc1)/C=C/1\N=C(N=C1O)c1ccccc1Br)C

STK594143
Synonyms: (5-bromo-3-methyl-1H-indol-2-yl)(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)methanone
Smiles: Brc1ccc2c(c1)c(C)c([nH]2)C(=O)N1CCC2(CC1)OCCO2

STK594145
Synonyms: N-[2-(7-methoxy-6-{(E)-[2-(2,4,6-trichlorophenyl)hydrazinylidene]methyl}-1,3-benzodioxol-5-yl)ethyl]-N-methylpropanamide
Smiles: CCC(=O)N(CCc1cc2OCOc2c(c1/C=N/Nc1c(Cl)cc(cc1Cl)Cl)OC)C

STK594146
Synonyms: 8-(azepan-1-yl)-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)OCC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCCC1)O

STK594149
Synonyms: 4-[(6E)-5-iminio-7-oxo-6-(thiophen-3-ylmethylidene)-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl]phenolate
Smiles: [O-]c1ccc(cc1)c1nn2c(=NC(=O)/C(=C/c3cscc3)/C2=[NH2+])s1

STK594151
Synonyms: N-(4-chlorophenyl)-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Cl)nnc1COc1ccccc1

STK594152
Synonyms: methylN-(prop-2-en-1-ylcarbamoyl)-L-leucinate
Smiles: C=CCNC(=O)N[C@H](C(=O)OC)CC(C)C

STK594153
Synonyms: 2-(ethylsulfanyl)-9-(2-fluorophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1ccccc1F

STK594154
Synonyms: 7-methyl-3-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CC(CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2)/C1=O)C

STK594155
Synonyms: 2-[(3,4-dimethoxyphenyl)sulfonyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc(ccc1OC)S(=O)(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STK594156
Synonyms: 1,7-dimethyl-3-(3-phenylpropyl)-8-(tetrahydrofuran-2-ylmethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cn1c(=O)n(CCCc2ccccc2)c(=O)c2c1nc1n2cc(n1CC1CCCO1)C

STK594157
Synonyms: 7-(2-fluorobenzyl)-1,3-dimethyl-8-[(4-methylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)Cc1nc2c(n1Cc1ccccc1F)c(=O)n(c(=O)n2C)C

STK594158
Synonyms: N-[(2E)-6-ethoxy-4-methylquinazolin-2(1H)-ylidene]-5-[3-(morpholin-4-yl)propyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: CCOc1ccc2c(c1)c(C)n/c(=N/C1=NCN(CN1)CCCN1CCOCC1)/[nH]2

STK594159
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(naphthalen-1-yl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1cccc2c1cccc2

STK594160
Synonyms: N-(3-chlorophenyl)-2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Cl)nnc1Cc1cccs1

STK594161
Synonyms: methyl5-amino-7-(1,3-benzodioxol-5-yl)-6-cyano-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate
Smiles: COC(=O)c1c(C)sc2c1OC(=C(C2c1ccc2c(c1)OCO2)C#N)N

STK594162
Synonyms: 9-(5-methyl-1,2-oxazol-3-yl)-8-(4-propoxyphenyl)-8,9-dihydrobenzo[7,8]chromeno[2,3-c]pyrrole-7,10-dione
Smiles: CCCOc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK594163
Synonyms: 4-hydroxy-1-methyl-7,8-diphenyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Oc1nc(=O)n(c2c1n1cc(n(c1n2)c1ccccc1)c1ccccc1)C

STK594164
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(4-nitrophenyl)carbonyl]-3'-{[4-(propan-2-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CC(Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3)C

STK594165
Synonyms: 3-[(4-chlorophenoxy)methyl]-5-[(2,5-dimethylbenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Smiles: C=CCn1c(nnc1SCc1cc(C)ccc1C)COc1ccc(cc1)Cl

STK594166
Synonyms: 6,7-dimethoxy-1-methyl-N-propyl-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Smiles: CCCNC(=S)N1CCc2c(C1C)cc(c(c2)OC)OC

STK594168
Synonyms: 1-(4-fluorophenyl)-2-({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)F)nnc1COc1ccc(cc1)C

STK594171
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dimethylphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(c(c1)C)C

STK594173
Synonyms: N'-[(3Z)-5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-5-(2-chlorophenyl)-1H-pyrazole-3-carbohydrazide
Smiles: Brc1ccc2c(c1)/C(=N/NC(=O)c1n[nH]c(c1)c1ccccc1Cl)/C(=O)N2

STK594174
Synonyms: N'-[(E)-(2-chloro-6-methylquinolin-3-yl)methylidene]pyridine-4-carbohydrazide
Smiles: Cc1ccc2c(c1)cc(c(n2)Cl)/C=N/NC(=O)c1ccncc1

STK594175
Synonyms: N-(1,3-benzodioxol-5-yl)-2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK594176
Synonyms: N-[(1Z)-1-{1-cyano-2-[(3-methoxypropyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-2-methylbenzamide
Smiles: COCCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccccc1C)/C#N

STK594177
Synonyms: 8-[4-(2-chlorobenzyl)piperazin-1-yl]-7-hexyl-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1Cl

STK594178
Synonyms: (4E)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-[hydroxy(4-methylphenyl)methylidene]-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)c1nnc(s1)SCc1ccccc1)/O

STK594179
Synonyms: 9-(2-fluorophenyl)-6-(2-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Cc1ccccc1C1CC(=C2C(=Nc3n(C2c2ccccc2F)ncn3)C1)O

STK594180
Synonyms: 1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-ylN-[(4-methylphenyl)sulfonyl]-D-leucinate
Smiles: CC(C[C@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)NS(=O)(=O)c1ccc(cc1)C)C

STK594181
Synonyms: ethyl2-(butanoylamino)-5-(propan-2-yl)-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: CCCC(=O)Nc1sc2c(c1C(=O)OCC)CC(OC2)C(C)C

STK594182
Synonyms: (5E)-1-(4-methoxyphenyl)-5-[(2-phenyl-1H-indol-3-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2c([nH]c3c2cccc3)c2ccccc2)/C1=O

STK594183
Synonyms: 1-benzyl-2-[(4-ethylpiperazin-1-yl)carbonyl]-9-methylpyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: CCN1CCN(CC1)C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C

STK594184
Synonyms: (4E)-5-(2-fluorophenyl)-1-hexadecyl-4-[hydroxy(4-methylphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCCCCCCCCCCCCCN1C(c2ccccc2F)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O

STK594187
Synonyms: 6-chloro-3,4-dimethyl-2-oxo-2H-chromen-7-ylN-[(benzyloxy)carbonyl]-L-isoleucinate
Smiles: CC[C@H]([C@@H](C(=O)Oc1cc2oc(=O)c(c(c2cc1Cl)C)C)NC(=O)OCc1ccccc1)C

STK594188
Synonyms: 4-{[(E)-(5-bromo-2-fluorophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cc(Br)ccc1F

STK594189
Synonyms: N-benzyl-2-(10-methoxy-6-oxo-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-7(6H)-yl)acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2CC(=O)NCc1ccccc1

STK594190
Synonyms: 6-(3-chlorobenzyl)-9-methoxy-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2Cc1cccc(c1)Cl

STK594191
Synonyms: 5-chloro-N,N-bis(2-methoxyethyl)-1H-indole-2-carboxamide
Smiles: COCCN(C(=O)c1cc2c([nH]1)ccc(c2)Cl)CCOC

STK594192
Synonyms: N-[(2Z)-5-[(4-chlorobenzyl)sulfonyl]-1,3,4-thiadiazol-2(3H)-ylidene]-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)/N=c\1/[nH]nc(s1)S(=O)(=O)Cc1ccc(cc1)Cl

STK594195
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(2,5-dimethoxyphenyl)carbonyl]-3'-[(2-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)OC

STK594197
Synonyms: (2E)-1-cyclopentyl-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)ethanone
Smiles: COc1cc2/C(=C\C(=O)C3CCCC3)/NCCc2cc1OC

STK594201
Synonyms: 1'-(4-chlorophenyl)-2'-hydroxy-3-methyl-8-nitro-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: CC1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)c1ccc(cc1)Cl)O

STK594204
Synonyms: N-methyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccccc1)C

STK594206
Synonyms: 10-(2-chlorophenyl)-1,3-dimethyl-5-phenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Clc1ccccc1C1OCCn2c1c1c(c2c2ccccc2)c(=O)n(c(=O)n1C)C

STK594207
Synonyms: 6-methyl-5-(naphthalen-1-ylmethyl)-2-(4-phenylpiperazin-1-yl)pyrimidin-4-ol
Smiles: Cc1nc(nc(c1Cc1cccc2c1cccc2)O)N1CCN(CC1)c1ccccc1

STK594208
Synonyms: 1-methyl-3-[(2S)-1-oxo-3-phenyl-1-(piperidin-1-yl)propan-2-yl]quinazoline-2,4(1H,3H)-dione
Smiles: O=c1n([C@H](C(=O)N2CCCCC2)Cc2ccccc2)c(=O)c2c(n1C)cccc2

STK594209
Synonyms: 2-{(E)-[2-(6-hydroxy-3-methyl-2-oxo-7-propyl-3,7-dihydro-2H-purin-9-ium-8-yl)hydrazinylidene]methyl}-6-methoxyphenolate
Smiles: CCCn1c(N/N=C/c2cccc(c2[O-])OC)[nH+]c2c1c(O)nc(=O)n2C

STK594211
Synonyms: 2-(4-tert-butylphenyl)-3-(3-methoxypropyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccc(cc1)C(C)(C)C

STK594215
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1c(ccc(c1OC)OC)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK594217
Synonyms: 7-chloro-1-(2,5-dimethoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl)OC

STK594218
Synonyms: 7-hydroxy-3-(4-methoxyphenoxy)-8-[(3-methylpiperidin-1-yl)methyl]-4H-chromen-4-one
Smiles: COc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2CN1CCCC(C1)C)O

STK594219
Synonyms: N-(2,3-dimethylphenyl)-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]furan-2-carboxamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(c1cccc(c1C)C)C(=O)c1ccco1

STK594220
Synonyms: N-(3,4-difluorophenyl)-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CCCn1cnc2c(c1=O)cccc2

STK594222
Synonyms: methyl4-{[2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanoyl]amino}benzoate
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1ccc(cc1)C(=O)OC

STK594225
Synonyms: 2-ethoxy-4-{(Z)-[2-(3-fluorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenylbutanoate
Smiles: CCCC(=O)Oc1ccc(cc1OCC)/C=C/1\N=C(OC1=O)c1cccc(c1)F

STK594227
Synonyms: N-(3,5-dichlorophenyl)-2,8,10-trimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-4-amine
Smiles: Clc1cc(cc(c1)Cl)Nc1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK594228
Synonyms: (2S)-N-(4-fluorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: O=C([C@@H](n1c(O)nc2c(c1=O)cccc2)C)Nc1ccc(cc1)F

STK594229
Synonyms: N-benzyl-4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NCc1ccccc1

STK594230
Synonyms: (5Z)-5-(butan-2-ylidene)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1,3-thiazol-4(5H)-one
Smiles: CC/C(=C/1\SC(=NC1=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F)/C

STK594231
Synonyms: 8-benzyl-N-[2-(morpholin-4-yl)ethyl]-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-amine
Smiles: O1CCN(CC1)CCNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1

STK594234
Synonyms: methyl2-[(3E)-3-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-4,5-dioxo-2-phenylpyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC(C)C)/O)/C1c1ccccc1

STK594235
Synonyms: N-(3-bromophenyl)-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Br)nnc1c1cccc(c1)C

STK594236
Synonyms: methylN-[(2-methylpropyl)carbamoyl]-L-phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)NCC(C)C

STK594237
Synonyms: 10-(3-chlorophenyl)-9-hydroxy-6,7,8,10-tetrahydro-11H-indeno[1,2-b]quinolin-11-one
Smiles: Clc1cccc(c1)C1C2=C(O)CCCC2=NC2=C1C(=O)c1c2cccc1

STK594239
Synonyms: 2-(1,3-benzothiazol-2-yl)-1-(4-ethoxy-3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1OC)C1N(c2nc3c(s2)cccc3)C(=O)c2c1c(=O)c1c(o2)cccc1

STK594240
Synonyms: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-N-[2-(phenylsulfanyl)phenyl]acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1ccccc1Sc1ccccc1

STK594241
Synonyms: 8-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK594244
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2,4-dichlorophenyl)carbonyl]-2'-[(4-propylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2Cl)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK594245
Synonyms: 2-(4-tert-butylphenyl)-10-methyl-3-(3-methylbutyl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CC(CCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccc(cc1)C(C)(C)C)C

STK594247
Synonyms: (2S)-N-butyl-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-3-phenylpropanamide
Smiles: CCCCNC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)Cc1ccccc1

STK594249
Synonyms: (4E)-5-(3-ethoxy-4-hydroxyphenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OCC)/O)/C1c1ccc(c(c1)OCC)O

STK594250
Synonyms: 7-[(2,2-diethoxyethyl)sulfanyl]-12,12-dimethyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Smiles: CCOC(CSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C)OCC

STK594251
Synonyms: 3-[(4-bromobenzyl)sulfanyl]-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-4-amine
Smiles: Cc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCc1ccc(cc1)Br

STK594252
Synonyms: 3-(3-bromo-4-fluorophenyl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(c(c1)Br)F

STK594253
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-(butan-2-yl)phenyl]acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)OC)C

STK594254
Synonyms: 1-(4-ethylphenyl)-4-(4-methoxyphenyl)-N-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCc1ccc(cc1)c1c(C(=O)Nc2ccccc2)n2c3c1CCCCn3c(c2)c1ccc(cc1)OC

STK594256
Synonyms: (3E)-4-imino-7,8-dimethyl-3-[(4-oxo-4H-chromen-3-yl)methylidene]-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one
Smiles: O=C1N=c2sc3c(n2C(=N)/C/1=C\c1coc2c(c1=O)cccc2)cc(c(c3)C)C

STK594257
Synonyms: (4E,5Z)-5-[4-(dimethylamino)benzylidene]-4-[(4-methoxyphenyl)imino]-1,3-thiazolidin-2-one
Smiles: COc1ccc(cc1)/N=C\1/NC(=O)S/C1=C\c1ccc(cc1)N(C)C

STK594258
Synonyms: 2-methoxy-6-[4-(3-methylphenoxy)quinazolin-2-yl]phenol
Smiles: COc1cccc(c1O)c1nc(Oc2cccc(c2)C)c2c(n1)cccc2

STK594259
Synonyms: 6-benzyl-5-methyl-2-{[4-(propan-2-yl)benzyl]amino}[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1nc2nc(nn2c(c1Cc1ccccc1)O)NCc1ccc(cc1)C(C)C

STK594260
Synonyms: (3a'S,6a'R)-5'-(butan-2-yl)-5-chloro-3'-(2-methylpropyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1cc(Cl)cc2)C

STK594262
Synonyms: 3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCOCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2)/C1=O

STK594264
Synonyms: 1-methyl-3-(3-methylbutyl)-8-(2-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CC(CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C)C

STK594265
Synonyms: 2-[(6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]-N-(pyridin-2-ylmethyl)propanamide
Smiles: O=C(C(Oc1ccc2c(c1)oc(=O)c1c2CCCC1)C)NCc1ccccn1

STK594267
Synonyms: 2-(6-chloro-1,3-benzothiazol-2-yl)-1-[3-(prop-2-en-1-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: C=CCOc1cccc(c1)C1N(c2sc3c(n2)ccc(c3)Cl)C(=O)c2c1c(=O)c1c(o2)cccc1

STK594268
Synonyms: 8-(3-methoxy-4-propoxyphenyl)-9-(5-methyl-1,2-oxazol-3-yl)-8,9-dihydrobenzo[7,8]chromeno[2,3-c]pyrrole-7,10-dione
Smiles: CCCOc1ccc(cc1OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK594269
Synonyms: 2-(10-methoxy-6-oxo-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-7(6H)-yl)-N-[3-(methylsulfanyl)phenyl]acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2CC(=O)Nc1cccc(c1)SC

STK594270
Synonyms: tert-butyl(3S)-3-({(2S)-3-methyl-1-[(4-methylphenyl)amino]-1-oxobutan-2-yl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: Cc1ccc(cc1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK594271
Synonyms: (3R,3'S,3a'S,6a'R)-5'-(2-fluorophenyl)-3'-(4-hydroxybenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Oc1ccc(cc1)C[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1F)C(=O)Nc1c2cccc1

STK594272
Synonyms: tert-butyl(2-{5-[(2-fluorobenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}ethyl)carbamate
Smiles: O=C(OC(C)(C)C)NCCc1nnc(o1)S(=O)(=O)Cc1ccccc1F

STK594273
Synonyms: N-(3,4-dimethoxybenzyl)-5-fluoro-N-(prop-2-en-1-yl)-1H-indole-2-carboxamide
Smiles: C=CCN(C(=O)c1cc2c([nH]1)ccc(c2)F)Cc1ccc(c(c1)OC)OC

STK594274
Synonyms: 4,7-dimethoxy-N'-{(E)-[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1H-indole-2-carbohydrazide
Smiles: C=CCOc1ccc(cc1)/C=N/NC(=O)c1[nH]c2c(c1)c(OC)ccc2OC

STK594276
Synonyms: 2-chloro-4-{(Z)-[2-(4-iodophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-6-methoxyphenylacetate
Smiles: COc1cc(/C=C/2\N=C(OC2=O)c2ccc(cc2)I)cc(c1OC(=O)C)Cl

STK594277
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(3-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)/C(=C\1/C(c2cccc(c2)[N+](=O)[O-])N(C(=O)C1=O)c1cccc(c1)C(F)(F)F)/O

STK594278
Synonyms: (4E)-2-(3-chlorophenyl)-4-[(methylamino)methylidene]isoquinoline-1,3(2H,4H)-dione
Smiles: CN/C=C\1/C(=O)N(c2cccc(c2)Cl)C(=O)c2c1cccc2

STK594279
Synonyms: N-[(2Z)-3-(2-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenylacetamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccccc1F)CS(=O)(=O)C2)Cc1ccccc1

STK594281
Synonyms: methylN-[(2-fluorobenzyl)carbamoyl]-D-valinate
Smiles: COC(=O)[C@@H](C(C)C)NC(=O)NCc1ccccc1F

STK594282
Synonyms: 6-hydroxy-3,7-dimethyl-8-{(2E)-2-[4-(propan-2-yl)benzylidene]hydrazinyl}-3,7-dihydro-2H-purin-2-one
Smiles: CC(c1ccc(cc1)/C=N/Nc1nc2c(n1C)c(O)nc(=O)n2C)C

STK594283
Synonyms: 6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(4-methylbenzyl)hexanamide
Smiles: O=C(NCc1ccc(cc1)C)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK594285
Synonyms: 1-{5-chloro-4-[(2-methoxybenzyl)amino]-6-oxopyridazin-1(6H)-yl}tricyclo[3.3.1.1~3,7~]decane-2-carboxylicacid
Smiles: COc1ccccc1CNc1cnn(c(=O)c1Cl)C12CC3CC(C1)CC(C2C(=O)O)C3

STK594288
Synonyms: (4Z)-2-(2,4-dichlorophenyl)-4-(4-ethoxy-3-methoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: CCOc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1ccc(cc1Cl)Cl

STK594289
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccc(cc1)OCC

STK594290
Synonyms: 2-(furan-2-yl)-3-(furan-2-ylmethyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: O=c1c2ccccc2oc2c1c(=O)n(c(n2)c1ccco1)Cc1ccco1

STK594291
Synonyms: 2-[4-(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)piperazin-1-yl]ethanol
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCN(CC1)CCO

STK594292
Synonyms: (3a'S,6a'R)-5'-cyclohexyl-3'-(3,4-dihydroxybenzyl)-5-fluoro-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C1CCCCC1)Cc1ccc(c(c1)O)O)C(=O)N2

STK594293
Synonyms: 8-(4-ethoxyphenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK594294
Synonyms: 7-[(4-methoxybenzyl)sulfanyl]-11-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Smiles: COc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CCC(C3)C

STK594296
Synonyms: 7-chloro-6-(2-chloroethyl)-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidine
Smiles: ClCCc1c(C)nc2n(c1Cl)nc(c2c1ccccc1)C

STK594297
Synonyms: 9-(2,4-difluorophenyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Smiles: Fc1ccc(c(c1)F)N1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK594299
Synonyms: 8-ethyl-N-(pyridin-4-ylmethyl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-amine
Smiles: CCN1CCc2c(C1)sc1c2c(NCc2ccncc2)nc2n1nnn2

STK594300
Synonyms: (5E)-3-benzyl-5-(1-{[4-(dimethylamino)phenyl]amino}propylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O)/Nc1ccc(cc1)N(C)C

STK594301
Synonyms: 3-(3-methoxypropyl)-2-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)C(C)C

STK594302
Synonyms: (4E)-2-(2,5-dimethoxyphenyl)-4-{[(2-hydroxyethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: OCCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1cc(OC)ccc1OC

STK594303
Synonyms: N-[(2Z)-6-chloro-4-phenylquinazolin-2(1H)-ylidene]-5-[3-(morpholin-4-yl)propyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: Clc1ccc2c(c1)c(n/c(=N\C1=NCN(CN1)CCCN1CCOCC1)/[nH]2)c1ccccc1

STK594304
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)c1nc2c(s1)cc(cc2)C

STK594305
Synonyms: (2'S,3S,3'S,10b'R)-2'-(1-benzofuran-2-ylcarbonyl)-3'-(phenylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cc4c(o1)cccc4)C(=O)Nc1c2cccc1)cccc3)c1ccccc1

STK594306
Synonyms: methyl3-({(1Z)-1-[4-hydroxy-1-(4-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]ethyl}amino)benzoate
Smiles: COC(=O)c1cccc(c1)N/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/C

STK594308
Synonyms: 3-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)ammonio]benzoate
Smiles: CCc1nc([NH2+]c2cccc(c2)C(=O)[O-])c2c(n1)c1ccccc1o2

STK594309
Synonyms: (2Z,5Z)-2-[(2-chlorophenyl)imino]-5-(3-hydroxy-4-methoxybenzylidene)-2,5-dihydro-1,3-thiazol-4-ol
Smiles: COc1ccc(cc1O)/C=C/1\S/C(=N\c2ccccc2Cl)/N=C1O

STK594310
Synonyms: (5Z)-2-(3-bromophenyl)-5-(3,4-dimethoxybenzylidene)-3-(1,3-thiazol-2-yl)-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1cc(ccc1OC)/C=C/1\N=C(N(C1=O)c1nccs1)c1cccc(c1)Br

STK594311
Synonyms: 3,4,8,9-tetramethyl-1,6-diphenyl-1,3a,4,6,9,10a-hexahydro-4,9-methano[1,5]dioxocino[2,3-c:6,7-c']dipyrazole
Smiles: CC1=NN(C2C1C1(C)Oc3c(C(O2)(C1)C)c(nn3c1ccccc1)C)c1ccccc1

STK594312
Synonyms: 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]-N-(pyridin-4-ylmethyl)acetamide
Smiles: O=C(NCc1ccncc1)COc1cc2oc(=O)c3c(c2cc1Cl)CCC3

STK594313
Synonyms: 6-{(E)-[(2E)-(5-{2-[(4-bromophenyl)amino]-2-oxoethyl}-4-oxo-1,3-thiazolidin-2-ylidene)hydrazinylidene]methyl}-2,3-dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)/C=N/N=C/1\NC(=O)C(S1)CC(=O)Nc1ccc(cc1)Br

STK594315
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-methoxyphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2OC)nnc1COc1ccc(cc1)Cl

STK594316
Synonyms: 1-(4-methoxyphenyl)-6-(1-phenylethyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)C(c1ccccc1)C

STK594317
Synonyms: 2-{(3aR,4R,4aR,7aS,8R,8aR)-3-[4-(benzyloxy)-3-methoxyphenyl]-5,7-dioxo-3a,4,4a,5,7,7a,8,8a-octahydro-6H-4,8-methano[1,2]oxazolo[4,5-f]isoindol-6-yl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: COc1cc(ccc1OCc1ccccc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1sc2c(c1C#N)CCCC2

STK594318
Synonyms: [3-(difluoromethoxy)phenyl](6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)c1cccc(c1)OC(F)F

STK594320
Synonyms: N-(3-fluoro-4-methylphenyl)-2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1Cc1cccs1

STK594323
Synonyms: (1'S,3R,3'S,7a'S)-6''-chloro-7''-methyl-1'-[(3-propoxyphenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCCOc1cccc(c1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2ccc(c1C)Cl

STK594324
Synonyms: N-(4-propyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)ethane-1,2-diamine
Smiles: CCCc1nc2sc3c(c2c2c1CCC2)ncnc3NCCN

STK594325
Synonyms: 4-methoxy-N-(7-methoxy-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-1-yl)benzamide
Smiles: COc1ccc(cc1)C(=O)NN1CCc2c1nc1cc(OC)ccc1c2

STK594326
Synonyms: N-{4-[(3a'S,6a'R)-5-chloro-3'-(1H-indol-3-ylmethyl)-2,4',6'-trioxo-1,2,2',3',3a',4',6',6a'-octahydro-5'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(Cl)cc2

STK594327
Synonyms: 9-(4-fluorophenyl)-4-hydroxy-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purin-2(1H)-one
Smiles: Fc1ccc(cc1)N1CCCn2c1nc1c2c(O)nc(=O)n1C

STK594328
Synonyms: 4-{[(E)-(4-chlorophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)Cl

STK594331
Synonyms: (4E)-1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: C=CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK594333
Synonyms: 2-(6-chloro-1,3-benzothiazol-2-yl)-1-(3-fluorophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)c2c1c(=O)c1c(o2)cccc1

STK594334
Synonyms: 9-(2,2-diphenylethyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c2c1CCC2)CC(c1ccccc1)c1ccccc1

STK594335
Synonyms: 3-(2,4-dimethoxyphenyl)-7-(4-methylphenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: COc1cc(OC)ccc1C1=NOC2(C1)CC(=O)N(C2=O)c1ccc(cc1)C

STK594336
Synonyms: (E)-[2-(2-fluorophenyl)-4,5-dioxo-1-(pyridinium-4-ylmethyl)pyrrolidin-3-ylidene](2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: CC1Cc2c(O1)ccc(c2)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)Cc1cc[nH+]cc1)/[O-]

STK594337
Synonyms: 9-methoxy-6-(4-methylbenzyl)-6H-indolo[2,3-b]quinoxaline
Smiles: COc1ccc2c(c1)c1nc3ccccc3nc1n2Cc1ccc(cc1)C

STK594339
Synonyms: ethyl1'-tert-butyl-2'-hydroxy-8-nitro-4',6'-dioxo-1',2,3,4,4a,6'-hexahydro-1H,4'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)C1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)C(C)(C)C)O

STK594340
Synonyms: 9-(3-chlorophenyl)-6-(2-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Clc1cccc(c1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1O

STK594343
Synonyms: 2-{[4-ethyl-5-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1c1ccccc1F

STK594344
Synonyms: 2-(2,4-dimethoxyphenyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline1,4-dioxide
Smiles: COc1cc(OC)ccc1c1c(C)[n+]([O-])c2c([n+]1[O-])CCCC2

STK594345
Synonyms: 2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(C)C)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK594346
Synonyms: 6-chloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-7-methyl-N-(4-methylbenzyl)-4-oxo-4H-chromene-2-carboxamide
Smiles: Cc1ccc(cc1)CN(C(=O)c1cc(=O)c2c(o1)cc(c(c2)Cl)C)C1CCS(=O)(=O)C1

STK594347
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-3-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CC(CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)/C1=O)C

STK594351
Synonyms: N-[6-chloro-4-oxo-3-(3,4,5-trimethoxyphenyl)-4H-chromen-2-yl]-4-fluorobenzamide
Smiles: COc1cc(cc(c1OC)OC)c1c(NC(=O)c2ccc(cc2)F)oc2c(c1=O)cc(cc2)Cl

STK594352
Synonyms: (4E)-4-[(1,3-benzothiazol-2-ylamino)methylidene]-2-(3,4-dimethylphenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1N(c2ccc(c(c2)C)C)C(=O)c2c(/C/1=C\Nc1nc3c(s1)cccc3)cccc2

STK594354
Synonyms: ethyl4-{1-methyl-3-[2-(morpholin-4-yl)ethyl]-2,4-dioxo-1,2,3,4,6,7-hexahydro-8H-imidazo[2,1-f]purin-8-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK594355
Synonyms: 7-chloro-6-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1-(3,4,5-trimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1c(OC)cc(cc1OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK594356
Synonyms: 2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(C)ccc2C)nnc1c1cccc(c1)Cl

STK594357
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-9-methyl-3-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2F)/C1=O

STK594359
Synonyms: 2-(furan-2-yl)-3-hexyl-8-methoxy-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: CCCCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cc(cc1)OC)c1ccco1

STK594360
Synonyms: (5Z)-6-hydroxy-5-[2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-ylidene]-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C/2\CC(Sc3c(N2)cccc3)c2ccc(cc2)OC)/C1=O)O

STK594361
Synonyms: 8-(2,4-dimethoxyphenyl)-1,6,7-trimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cc(OC)ccc1n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCCCC1

STK594363
Synonyms: 5-{3-[(4-chlorobenzyl)oxy]phenyl}-N'-[(E)-(2-hydroxynaphthalen-1-yl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: Clc1ccc(cc1)COc1cccc(c1)c1[nH]nc(c1)C(=O)N/N=C/c1c(O)ccc2c1cccc2

STK594364
Synonyms: 1-tert-butyl4-(6-chloro-2-oxo-4-propyl-2H-chromen-7-yl)piperidine-1,4-dicarboxylate
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK594366
Synonyms: 2-hydroxy-3-methyl-6-[(2E)-1-methyl-2-(pyridin-2-ylmethylidene)hydrazinyl]pyrimidin-4(3H)-one
Smiles: CN(c1cc(=O)n(c(n1)O)C)/N=C/c1ccccn1

STK594369
Synonyms: N-(2-methoxyethyl)-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinolin-8-amine
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3NCCOC

STK594370
Synonyms: 3-(1,3-benzodioxol-5-yl)-6-methyl-N-(pyridin-2-ylmethyl)heptan-1-amine
Smiles: CC(CCC(c1ccc2c(c1)OCO2)CCNCc1ccccn1)C

STK594372
Synonyms: methylN-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}carbonyl)-D-phenylalaninate
Smiles: COC(=O)[C@H](NC(=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F)Cc1ccccc1

STK594374
Synonyms: 4-phenyl-7-{[2-(piperidin-1-yl)ethyl]sulfanyl}-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: C1CCN(CC1)CCSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK594375
Synonyms: 9-methyl-2-(pyridin-4-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC1CCc2c(C1)sc1c2c2nc(nn2cn1)c1ccncc1

STK594376
Synonyms: N-(2-bromophenyl)-2-({5-[(4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2Br)nnc1COc1ccc(cc1)C

STK594377
Synonyms: 4-hydroxy-8-(3-methoxyphenyl)-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: COc1cccc(c1)n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK594379
Synonyms: (2S)-N-(3-acetylphenyl)-3-methyl-2-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: CC([C@H](n1cnc2c(c1=O)cccc2)C(=O)Nc1cccc(c1)C(=O)C)C