FULL DB

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

STK571763
Synonyms: N-[6-chloro-3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl]furan-2-carboxamide
Smiles: Fc1ccc(cc1)c1c(NC(=O)c2ccco2)oc2c(c1=O)cc(cc2)Cl

STK571764
Synonyms: (8S,8aR,11aS)-N-(4-methoxyphenyl)-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: COc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3

STK571765
Synonyms: 6-benzyl-1-(4-fluorophenyl)-2-hydroxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Fc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)Cc1ccccc1

STK571766
Synonyms: 1-[11-(2-chlorophenyl)-3-(4-fluorophenyl)-1-hydroxy-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone
Smiles: Fc1ccc(cc1)C1CC(=C2C(=Nc3ccccc3N(C2c2ccccc2Cl)C(=O)C)C1)O

STK571767
Synonyms: 3-tert-butyl-5-(2-ethyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-2,6-dihydroxypyrimidin-4(3H)-one
Smiles: CCN1CCc2c(C1c1c(O)nc(n(c1=O)C(C)(C)C)O)[nH]c1c2cccc1

STK571768
Synonyms: N-(2,6-dibromo-4-methylphenyl)-2-{[4-ethyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2c(Br)cc(cc2Br)C)nnc1COc1ccccc1

STK571769
Synonyms: 1-(2-chlorophenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: O=C(c1ccccc1Cl)CSc1nnc(n1c1ccccc1)c1cnccn1

STK571770
Synonyms: 7,7-dimethyl-2-(3-methylphenyl)-4-{[2-(piperidin-1-yl)ethyl]sulfanyl}-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: Cc1cccc(c1)c1nc(SCCN2CCCCC2)c2c(n1)CC(OC2)(C)C

STK571771
Synonyms: (3R,3'S,5'R)-5-bromo-N-(2,5-dimethoxyphenyl)-2-oxo-5'-(propan-2-yl)-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(Br)cc1)C(C)C)OC

STK571772
Synonyms: N-(4-methylphenyl)-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK571773
Synonyms: 3-[(5Z)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)propanamide
Smiles: O=C(NC1CCS(=O)(=O)C1)CCN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK571774
Synonyms: (4E)-2-(3-chloro-2-methylphenyl)-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1/C(=C/NCCCN2CCOCC2)/c2ccccc2C(=O)N1c1cccc(c1C)Cl

STK571775
Synonyms: N-{(2S)-3-methyl-1-[(4-methylphenyl)amino]-1-oxobutan-2-yl}-1-{N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}piperidine-4-carboxamide
Smiles: CC[C@H]([C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)C)C(C)C)NS(=O)(=O)c1ccc(cc1)C)C

STK571783
Synonyms: N-(2-hydroxypropyl)-5-methyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CC(CNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2)O

STK571784
Synonyms: 6,8-dichloro-N-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-4H-chromene-2-carboxamide
Smiles: CC(Cc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)c(Cl)cc(c3)Cl)/s1)C

STK571785
Synonyms: 8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(CN2CCN(CC2)c2ccc(cc2)OC)nc2c1c(=O)n(c(=O)n2C)C

STK571786
Synonyms: 5-fluoro-3-hydroxy-3-[2-(naphthalen-1-yl)-2-oxoethyl]-1,3-dihydro-2H-indol-2-one
Smiles: Fc1ccc2c(c1)C(O)(CC(=O)c1cccc3c1cccc3)C(=O)N2

STK571789
Synonyms: N-(3-methoxypropyl)-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-amine
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCCCOC

STK571790
Synonyms: 6-(3,4-dimethoxyphenyl)-9-(2-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1OC)C1CC(=C2C(=Nc3n(C2c2ccccc2C)ncn3)C1)O

STK571791
Synonyms: 12-chloro-3-[2-methyl-6-(propan-2-yl)phenyl]-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Smiles: Clc1cc2c(c3c1OCN(C3)c1c(C)cccc1C(C)C)oc(=O)c1c2CCCC1

STK571792
Synonyms: N-(2,4-dichlorophenyl)-2-[(7,8-dimethoxyphthalazin-1-yl)sulfanyl]acetamide
Smiles: COc1c(OC)ccc2c1c(nnc2)SCC(=O)Nc1ccc(cc1Cl)Cl

STK571794
Synonyms: N-(3,5-dichlorophenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)cc(c2)Cl)nnc1COc1ccc(cc1)C

STK571795
Synonyms: (6E)-4-(1-benzofuran-2-yl)-6-[(3,5-dichlorophenyl)imino]-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: Clc1cc(Cl)cc(c1)/N=c/1\[nH]c(N)nc(n1)c1cc2c(o1)cccc2

STK571796
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-chlorophenyl)carbonyl]-2'-[(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]1[C@@H](C(=O)c2ccc(cc2)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK571797
Synonyms: [2-chloro-5-(methylsulfanyl)phenyl](6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: CSc1ccc(c(c1)C(=O)N1CCc2c(C1=C)cc(c(c2)OC)OC)Cl

STK571798
Synonyms: N-(4-{[(3Z)-1-butyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]sulfamoyl}phenyl)acetamide
Smiles: CCCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)NC(=O)C)/c2c1nc1ccccc1c2

STK571803
Synonyms: 4-[(6Z)-6-{[2,5-dimethyl-1-(tetrahydrofuran-2-ylmethyl)-1H-pyrrol-3-yl]methylidene}-5-iminio-7-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl]phenolate
Smiles: [O-]c1ccc(cc1)c1nn2c(=NC(=O)/C(=C\c3cc(n(c3C)CC3CCCO3)C)/C2=[NH2+])s1

STK571805
Synonyms: tert-butyl(3S)-3-{[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]carbamoyl}-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: O=C([C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C)NC1CCCCC1

STK571806
Synonyms: 2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethoxyphenyl)acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK571807
Synonyms: 1-{5-methyl-1-[2-phenyl-6-(phenylamino)pyrimidin-4-yl]-1H-pyrazol-4-yl}ethanone
Smiles: CC(=O)c1cnn(c1C)c1cc(Nc2ccccc2)nc(n1)c1ccccc1

STK571808
Synonyms: 4-methyl-N-{[(2Z)-4-(3-nitrophenyl)-1,3-thiazol-2(3H)-ylidene]carbamothioyl}benzamide
Smiles: Cc1ccc(cc1)C(=O)NC(=S)/N=c/1\scc([nH]1)c1cccc(c1)[N+](=O)[O-]

STK571810
Synonyms: 2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(F)(F)F)nnc1COc1ccc(cc1)C

STK571812
Synonyms: 4-{[(E)-(2,6-dichlorophenyl)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/c1c(Cl)cccc1Cl

STK571815
Synonyms: 4-{[(E)-(2,3-dichlorophenyl)methylidene]amino}-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1cccc(c1Cl)Cl

STK571816
Synonyms: N-[1-(1H-benzimidazol-2-yl)-3-methyl-1H-pyrazol-5-yl]-4-nitrobenzamide
Smiles: Cc1nn(c(c1)NC(=O)c1ccc(cc1)[N+](=O)[O-])c1nc2c([nH]1)cccc2

STK571817
Synonyms: 5-(4-chlorophenyl)-10-(2,4-dihydroxyphenyl)-1,3-dimethyl-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(c3n1CCOC3c1ccc(cc1O)O)n(C)c(=O)n(c2=O)C

STK571818
Synonyms: N-(4-fluorobenzyl)-2-(9-methoxy-5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2CC(=O)NCc1ccc(cc1)F

STK571819
Synonyms: N'-[(E)-(3,4-dichlorophenyl)methylidene]-2-(3-hydroxy-5-methyl-4H-pyrazol-4-yl)acetohydrazide
Smiles: O=C(CC1C(=NN=C1O)C)N/N=C/c1ccc(c(c1)Cl)Cl

STK571820
Synonyms: N-(1-imino-1,3-dihydro-2H-isoindol-2-yl)-4-methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)NN1Cc2c(C1=N)cccc2

STK571822
Synonyms: N-{1-methyl-4-oxo-3-[3-(trifluoromethyl)phenyl]-1,4-dihydroquinolin-2-yl}-2-phenylacetamide
Smiles: O=C(Nc1n(C)c2ccccc2c(=O)c1c1cccc(c1)C(F)(F)F)Cc1ccccc1

STK571824
Synonyms: 2-(1,3-benzothiazol-2-yl)-1-(3-chlorophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1cccc(c1)C1N(c2nc3c(s2)cccc3)C(=O)c2c1c(=O)c1c(o2)cccc1

STK571826
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C

STK571827
Synonyms: 9-tert-butyl-N-[2-(morpholin-4-yl)ethyl]-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)sc2c1CCC(C2)C(C)(C)C)NCCN1CCOCC1

STK571829
Synonyms: (4E)-2-[2-chloro-5-(trifluoromethyl)phenyl]-4-[(methylamino)methylidene]isoquinoline-1,3(2H,4H)-dione
Smiles: CN/C=C\1/C(=O)N(c2cc(ccc2Cl)C(F)(F)F)C(=O)c2c1cccc2

STK571830
Synonyms: 2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-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)c1cccc(c1)C

STK571831
Synonyms: 3-(4-nitrophenyl)-7-[3-(trifluoromethyl)phenyl]-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: O=C1CC2(C(=O)N1c1cccc(c1)C(F)(F)F)ON=C(C2)c1ccc(cc1)[N+](=O)[O-]

STK571832
Synonyms: (2E)-N-[7-(4-fluorophenyl)-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-(3-nitrophenyl)prop-2-enamide
Smiles: O=C(Nc1[nH]c2=NC(=CC(n2n1)c1ccc(cc1)F)c1ccccc1)/C=C/c1cccc(c1)[N+](=O)[O-]

STK571834
Synonyms: (5Z)-3-(3,5-dichlorophenyl)-5-(3-fluorobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Fc1cccc(c1)/C=C/1\SC(=S)N(C1=O)c1cc(Cl)cc(c1)Cl

STK571835
Synonyms: 1,3-dimethyl-5-(4-methylphenyl)-10-(thiophen-2-yl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Cc1ccc(cc1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1cccs1

STK571836
Synonyms: methyl4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1

STK571838
Synonyms: 4-{[(E)-(2,3-dichlorophenyl)methylidene]amino}-5-[4-(dimethylamino)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CN(c1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cccc(c1Cl)Cl)C

STK571840
Synonyms: 8-(azepan-1-yl)-6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCCCCC1)COc1ccc(cc1)C

STK571841
Synonyms: 2-(3-bromophenyl)-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)c1cccc(c1)Br)C

STK571842
Synonyms: 1-(biphenyl-4-yl)-2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)c2ccccc2)nnc1c1ccc(cc1)C(C)(C)C

STK571843
Synonyms: 5-({4-[(5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)-2-hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)C(=O)O)O)CCCN1C(=S)S/C(=C\c2ccco2)/C1=O

STK571845
Synonyms: (4R,4aR)-2-amino-6-tert-butyl-4-(2,5-dimethoxyphenyl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCC(C2)C(C)(C)C)c1cc(OC)ccc1OC)(C#N)C#N

STK571846
Synonyms: N-(4-methoxyphenyl)-2-[(2-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CCCC3

STK571847
Synonyms: 6-methyl-5-(3-methylbutyl)-2-(phenylamino)pyrimidin-4-ol
Smiles: CC(CCc1c(C)nc(nc1O)Nc1ccccc1)C

STK571848
Synonyms: methylN-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamoyl}-L-methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)Nc1ccc(cc1)c1nc2c(s1)cccc2

STK571850
Synonyms: 7-methyl-14H-benzo[7',8']chromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-14-one
Smiles: O=c1c2ccc3c(c2oc2c1c1nc4c(n1c(n2)C)cccc4)cccc3

STK571852
Synonyms: 8-(3-chlorophenyl)-2-(furan-2-yl)-11-(2-methoxyphenyl)-10-methyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccco1)c1cccc(c1)Cl

STK571853
Synonyms: N-cyclopropyl-3-[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]propanamide
Smiles: O=C(NC1CC1)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)F

STK571854
Synonyms: (5E)-3-benzyl-5-{1-[(3,3-diphenylpropyl)amino]propylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O)/NCCC(c1ccccc1)c1ccccc1

STK571856
Synonyms: 3-(3,5-dichloro-2-hydroxyphenyl)-5-(2-ethoxyphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCOc1ccccc1N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1cc(Cl)cc(c1O)Cl

STK571857
Synonyms: N-({1-[3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]piperidin-4-yl}carbonyl)glycylglycine
Smiles: O=C(N1CCC(CC1)C(=O)NCC(=O)NCC(=O)O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C

STK571859
Synonyms: 9-(4-ethylphenyl)-2-(ethylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCSc1nc2n(n1)C(c1ccc(cc1)CC)C1=C(O)CCCC1=N2

STK571860
Synonyms: N-[3-(dimethylamino)propyl]-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-(4-methylphenyl)propanamide
Smiles: CN(CCCNC(=O)CC(c1ccc(cc1)C)C1CCOC(C1)(C)C)C

STK571861
Synonyms: N-(3,4-difluorophenyl)-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK571862
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-fluorophenyl)carbonyl]-2'-{[4-(prop-2-en-1-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: C=CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK571863
Synonyms: 4-[(2E)-2-(2,5-dimethoxybenzylidene)hydrazinyl]-5H-pyrimido[5,4-b]indole
Smiles: COc1ccc(c(c1)/C=N/Nc1ncnc2c1[nH]c1c2cccc1)OC

STK571867
Synonyms: 7-methyl-10-(pyridin-2-ylmethyl)-10,11-dihydro-5H,9H-benzo[3,4]chromeno[6,7-e][1,3]oxazin-5-one
Smiles: Cc1c2OCN(Cc2cc2c1oc(=O)c1c2cccc1)Cc1ccccn1

STK571868
Synonyms: 3-[(2,6-dimethylphenyl)amino]-6,7-dimethoxy-2-benzofuran-1(3H)-one
Smiles: COc1c(OC)ccc2c1C(=O)OC2Nc1c(C)cccc1C

STK571869
Synonyms: (5Z)-5-[1-acetyl-5-(4-chlorophenyl)pyrazolidin-3-ylidene]-1-(4-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(cc1)C1C/C(=C/2\C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)/NN1C(=O)C

STK571870
Synonyms: 1-hydroxy-9-oxo-9H-xanthen-3-ylN-[(4-methylphenyl)sulfonyl]-D-isoleucinate
Smiles: CC[C@@H]([C@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1)NS(=O)(=O)c1ccc(cc1)C)C

STK571872
Synonyms: 1-{4-[(2-chlorobenzyl)oxy]phenyl}-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(cc1)OCc1ccccc1Cl)c(=O)c1c(o2)cccc1

STK571875
Synonyms: (2Z)-N-phenyl-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)Nc1ccccc1

STK571876
Synonyms: 1-(3-chlorophenyl)-2-hydroxy-6-propyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2c1cccc(c1)Cl)O

STK571881
Synonyms: 4-(2-methoxy-5-nitrophenyl)-2-(2-methylphenyl)-5-phenyl-1H-imidazole
Smiles: COc1ccc(cc1c1nc([nH]c1c1ccccc1)c1ccccc1C)[N+](=O)[O-]

STK571884
Synonyms: 7-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-8-[benzyl(methyl)amino]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CN(c1nc2c(n1CCSc1nc3c(o1)cccc3)c(O)nc(=O)n2C)Cc1ccccc1

STK571887
Synonyms: N-(2-bromo-4,6-difluorophenyl)-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(F)cc(cc2Br)F)nnc1COc1ccc(cc1)Cl

STK571888
Synonyms: 4-fluoro-N-[(3E)-8-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)F)/c2c1nc1c(C)cccc1c2

STK571889
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2,5-dimethoxyphenyl)carbonyl]-2'-[(4-fluorophenyl)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]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)F)C(=O)Nc1c2cccc1)cccc3)OC

STK571890
Synonyms: 7-(2,4-dichlorobenzyl)-1,3-dimethyl-8-(piperidin-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(c(c1)Cl)Cn1c(CN2CCCCC2)nc2c1c(=O)n(C)c(=O)n2C

STK571891
Synonyms: N-(4-bromo-3-methylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)Br)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK571892
Synonyms: ethyl4-(4-chlorophenyl)-2-[(pyrrolidin-1-ylacetyl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)Cl)NC(=O)CN1CCCC1

STK571893
Synonyms: (2E,5E)-2-[(4-hydroxyphenyl)imino]-5-(4-methylbenzylidene)-2,5-dihydro-1,3-thiazol-4-ol
Smiles: Cc1ccc(cc1)/C=C\1/S/C(=N/c2ccc(cc2)O)/N=C1O

STK571895
Synonyms: ethyl5-acetyl-2-{[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)acetyl]amino}-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CN2CCc3c(C2)cc(c(c3)OC)OC)sc(c1C)C(=O)C

STK571897
Synonyms: 3-(1H-benzimidazol-2-yl)-N-(4-chlorobenzyl)propanamide
Smiles: O=C(CCc1nc2c([nH]1)cccc2)NCc1ccc(cc1)Cl

STK571900
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[methyl(phenyl)amino]methyl}-N'-[(E)-(2-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CN(c1ccccc1)C)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]

STK571901
Synonyms: N-[3-(methylsulfanyl)phenyl]-2-(5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)acetamide
Smiles: CSc1cccc(c1)NC(=O)Cn1c2ccccc2c2c1c(=O)n1c(n2)SCC1

STK571902
Synonyms: N-(4-fluorophenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1ccc(cc1)F

STK571903
Synonyms: (3a'S,6a'R)-5-chloro-5'-(2-methoxyethyl)-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: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cc(Cl)cc2

STK571904
Synonyms: 1,3-dimethyl-7-(2-methylbenzyl)-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccccc1Cn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK571905
Synonyms: 1-(4-hydroxy-5,6,7,8-tetrahydroquinazolin-2-yl)-3-[2-(phenylsulfanyl)phenyl]guanidine
Smiles: N=C(Nc1ccccc1Sc1ccccc1)Nc1nc(O)c2c(n1)CCCC2

STK571906
Synonyms: 3-amino-6-methyl-N-(2-phenylethyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: CC1CCc2c(C1)c(c1c(n2)sc(c1N)C(=O)NCCc1ccccc1)C(F)(F)F

STK571908
Synonyms: 2-(5,7-dihydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[2-(3-fluorophenyl)ethyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(O)cc(c2)O)NCCc1cccc(c1)F

STK571909
Synonyms: N-[3-(4-chlorophenyl)-1-ethyl-4-oxo-1,4-dihydroquinolin-2-yl]-2-methylpropanamide
Smiles: CCn1c(NC(=O)C(C)C)c(c2ccc(cc2)Cl)c(=O)c2c1cccc2

STK571910
Synonyms: 7-(2-fluorophenyl)-5-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Fc1ccccc1C1CC(Nc2n1ncn2)c1ccccc1

STK571911
Synonyms: (4E)-5-(4-ethylphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nnc(s1)C

STK571913
Synonyms: (1'S,3R,3'S,7a'S)-7''-ethyl-1'-(naphthalen-2-ylcarbonyl)-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCc1cccc2c1NC(=O)[C@@]12N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)cccc2

STK571915
Synonyms: N-[1-ethyl-4-oxo-3-(thiophen-2-yl)-1,4-dihydroquinolin-2-yl]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)Nc1c(c2cccs2)c(=O)c2c(n1CC)cccc2

STK571918
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)c1ccccc1

STK571920
Synonyms: 11-benzyl-3-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1cccc(c1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1

STK571925
Synonyms: (5Z)-5-{[(3-ethyl-2',6'-dihydroxy-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)CC)C(=NC(=NC2=O)O)O)/C1=O)O

STK571926
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-(4-methoxyphenyl)methanimine
Smiles: COc1ccc(cc1)/C=N\OCc1nc2n(n1)cnc1c2C(c2ccccc2Cl)c2c(O1)n(nc2C)c1ccccc1

STK571930
Synonyms: 6-(4-fluorophenyl)-9-(2-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Fc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccccc2C)ncn3)C1)O

STK571933
Synonyms: (4E)-2-(2,5-dimethoxyphenyl)-4-{[(4-methylpyridin-2-yl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccc(c(c1)N1C(=O)/C(=C/Nc2nccc(c2)C)/c2c(C1=O)cccc2)OC

STK571934
Synonyms: 3-(3-chlorophenyl)-2-{[2-(diethylamino)ethyl]amino}-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCN(CCNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C)CC

STK571935
Synonyms: 8-(3,5-dimethylphenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Cc1cc(C)cc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK571938
Synonyms: N-[4-(benzyloxy)phenyl]-2-({5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK571939
Synonyms: 9-(2,4-dichlorobenzyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Smiles: Clc1ccc(c(c1)Cl)CN1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK571940
Synonyms: N-[4-(4-chlorophenyl)-6-methyl-2-(4-methylphenyl)-5-oxo-2,5-dihydropyridazin-3-yl]furan-2-carboxamide
Smiles: Cc1ccc(cc1)n1nc(C)c(=O)c(c1NC(=O)c1ccco1)c1ccc(cc1)Cl

STK571941
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-3-{(Z)-[3-(furan-2-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2F)/C(=O)N1Cc1ccco1

STK571943
Synonyms: N-(2-tert-butylphenyl)-2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C(C)(C)C)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C

STK571944
Synonyms: 1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-yl2-{[(4-methylphenyl)sulfonyl]amino}butanoate
Smiles: CCC(C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)NS(=O)(=O)c1ccc(cc1)C

STK571945
Synonyms: ethyl4-{(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(c2ccc(c(c2)OC)OC)/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STK571949
Synonyms: 8-{[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl}-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: Clc1ccc(cc1S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1)C(F)(F)F

STK571950
Synonyms: N-(3-bromophenyl)-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Br)nnc1COc1ccccc1

STK571953
Synonyms: 7-[4-(3-chlorophenyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Clc1cccc(c1)N1CCN(CC1)c1cc(C)nc2n1ncn2

STK571954
Synonyms: N-[(4-phenyltetrahydro-2H-pyran-4-yl)methyl]benzenesulfonamide
Smiles: O=S(=O)(c1ccccc1)NCC1(CCOCC1)c1ccccc1

STK571957
Synonyms: (4E)-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(2-fluorophenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)c1nnc(s1)SCc1ccccc1F)/O

STK571958
Synonyms: (2Z)-7-{[benzyl(methyl)ammonio]methyl}-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)[N+](=O)[O-])/C2=O)Cc1ccccc1

STK571960
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK571963
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethyl-6-methylphenyl)acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1)C

STK571965
Synonyms: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-1-phenyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/c1ccc2c(c1)CCCN2Cc1ccccc1)c1ccccc1

STK571966
Synonyms: methylN-[(4-fluorobenzyl)carbamoyl]-D-phenylalaninate
Smiles: COC(=O)[C@@H](Cc1ccccc1)NC(=O)NCc1ccc(cc1)F

STK571968
Synonyms: N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylpropyl)benzenesulfonamide
Smiles: CC(CN(S(=O)(=O)c1ccccc1)Cc1cc2ccc(cc2[nH]c1=O)C)C

STK571969
Synonyms: 7-bromo-1-(3-ethoxyphenyl)-2-(1,3-thiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cccc(c1)C1N(c2nccs2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK571970
Synonyms: 5-(3-methoxyphenyl)-4-{[(E)-(2,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cc(OC)c(cc1OC)OC

STK571971
Synonyms: N-[(3Z)-7-methyl-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CC(Cn1[nH]/c(=N\S(=O)(=O)c2ccccc2)/c2c1nc1cc(C)ccc1c2)C

STK571974
Synonyms: N-(3-chloro-4-methoxyphenyl)-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: COc1ccc(cc1Cl)NC(=O)CCCn1cnc2c(c1=O)cccc2

STK571975
Synonyms: methyl5-cyano-4-(2-fluorophenyl)-6-({2-[(2-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-2-hydroxy-3,4-dihydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=NC(=C(C1c1ccccc1F)C#N)SCC(=O)Nc1ccccc1F)O

STK571976
Synonyms: (2R)-({N-[(2,5-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetyl]glycyl}amino)(phenyl)ethanoicacid
Smiles: O=C(N[C@H](c1ccccc1)C(=O)O)CNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C

STK571977
Synonyms: 2-(1,3-benzodioxol-5-yl)-4-imino-6,7,11,12-tetrahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc2OCCCOc2c1)c1ccc2c(c1)OCO2

STK571978
Synonyms: 2-{[3-cyano-5-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)N=C2C(=C(O)CCC2)C1c1ccc(c(c1)OC)O

STK571979
Synonyms: 7-(4-chlorobenzyl)-1,3-dimethyl-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)Cn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK571981
Synonyms: (5E)-3-butyl-5-(1-{[4-(diethylamino)phenyl]amino}ethylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCCCN1C(=O)N=C(/C(=C(\Nc2ccc(cc2)N(CC)CC)/C)/C1=O)O

STK571982
Synonyms: 2-(butylsulfanyl)-6-hydroxy-4-(4-methylphenyl)-4,5-dihydropyridine-3-carbonitrile
Smiles: CCCCSC1=C(C#N)C(CC(=N1)O)c1ccc(cc1)C

STK571983
Synonyms: 4-[3-acetyl-2-(4-bromophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzenesulfonamide
Smiles: Brc1ccc(cc1)C1N(c2ccc(cc2)S(=O)(=O)N)C(=O)C(=C1C(=O)C)O

STK571986
Synonyms: 2-(benzylsulfanyl)-9-(thiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: OC1=C2C(=Nc3n(C2c2cccs2)nc(n3)SCc2ccccc2)CCC1

STK571987
Synonyms: 4-{[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/C(=C/c1ccco1)/C)C

STK571988
Synonyms: 2-(6-methyl-1,3-benzothiazol-2-yl)-1-(3-propoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCCOc1cccc(c1)C1N(c2sc3c(n2)ccc(c3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK571989
Synonyms: N-(2-bromo-4-methylphenyl)-2-{[5-(3-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2Br)C)nnc1c1cccc(c1)C

STK571990
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(4-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1cccc(c1)C(F)(F)F

STK571992
Synonyms: N-(3,4-dimethoxyphenyl)-2-(5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)Cn1c2ccccc2c2c1c(=O)n1CCSc1n2

STK571993
Synonyms: ethyl{8-[(dibenzylamino)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Smiles: CCOC(=O)Cn1c(CN(Cc2ccccc2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK571994
Synonyms: 9-tert-butyl-N-(2-hydroxyethyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: OCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CCC(C2)C(C)(C)C

STK571998
Synonyms: (3a'S,6a'R)-5'-(4-fluorobenzyl)-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: Fc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C)C(=O)Nc2c1cccc2

STK572001
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl[2-(3-ethoxy-4-propoxyphenyl)-4,5-dioxo-1-(pyridinium-4-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: CCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1Cc1cc[nH+]cc1

STK572002
Synonyms: N-(1,3-benzodioxol-5-yl)-2-({5-[(4-chlorophenoxy)methyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK572003
Synonyms: N-(butan-2-yl)-5-methyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CCC(NC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2)C

STK572006
Synonyms: N-(2-ethoxyphenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccccc1)c1ccccn1

STK572007
Synonyms: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-1-(3,4-dimethylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/c1ccc2c(c1)CCCN2Cc1ccccc1)c1ccc(c(c1)C)C

STK572009
Synonyms: 4-chloro-N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}pyridine-3-carboxamide
Smiles: Clc1cn2c(CNC(=O)c3cnccc3Cl)nnc2c(c1)C(F)(F)F

STK572012
Synonyms: 1-(4-methoxyphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1nnc(n1c1ccccc1)c1cnccn1

STK572013
Synonyms: (3a'S,6a'R)-5'-(butan-2-yl)-5-chloro-3'-(3,4-dihydroxybenzyl)-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(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cc(Cl)cc2)C

STK572014
Synonyms: 2-(6-methyl-1,3-benzothiazol-2-yl)-1-(pyridin-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccnc1)c(=O)c1c(o2)cccc1

STK572015
Synonyms: 3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[4-(2-fluorophenyl)piperazin-1-yl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2F)/C1=O)C

STK572022
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-phenylpyrrolidine-2,3-dione
Smiles: Cc1nnc(s1)N1C(c2ccccc2)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=O

STK572023
Synonyms: 9-(3-chlorophenyl)-10-{[2-(dimethylamino)ethyl]amino}-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Smiles: CN(CCNc1nc2c3c(sc2c(=O)n1c1cccc(c1)Cl)nc(c1c3CC(C)(C)OC1)C)C

STK572025
Synonyms: 7-(2,4-dichlorobenzyl)-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)n(c(=O)n2C)C

STK572027
Synonyms: (1'R,2'R)-2'-(4-chlorophenyl)-1'-[(4-chlorophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)Cl)C(=O)c1c(C2=O)cccc1

STK572029
Synonyms: 2-({[4-(4-chlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1H-benzimidazole
Smiles: Clc1ccc(cc1)n1c(SCc2nc3c([nH]2)cccc3)nnc1c1cccc(c1)C

STK572031
Synonyms: (3-chloro-1-benzothiophen-2-yl)(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)c1sc2c(c1Cl)cccc2

STK572032
Synonyms: 3-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-8,8-dimethyl-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCc3nc4c([nH]3)cccc4)nnc2c2c1CC(C)(C)OC2

STK572033
Synonyms: (2S)-N-(5-chloro-2,4-dimethoxyphenyl)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: COc1cc(OC)c(cc1NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C(C)C)Cl

STK572035
Synonyms: N-(2-tert-butylphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C(C)(C)C)CSc1nnc(n1c1ccccc1)c1cnccn1

STK572036
Synonyms: 1-{4-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-6-hydroxypyrimidin-2-yl}-3-(2-methoxyphenyl)guanidine
Smiles: COc1ccccc1NC(=N)Nc1nc(CSc2nc3c(s2)cccc3)cc(n1)O

STK572037
Synonyms: 2-[(3aR,4R,4aR,7aS,8R,8aR)-3-(4-methylphenyl)-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: N#Cc1c(sc2c1CCCC2)N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2c1ccc(cc1)C

STK572039
Synonyms: 1-hydroxy-9-oxo-9H-xanthen-3-yltrans-4-{[(tert-butoxycarbonyl)amino]methyl}cyclohexanecarboxylate
Smiles: O=C(OC(C)(C)C)NC[C@@H]1CC[C@H](CC1)C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1

STK572041
Synonyms: (4E)-4-[(1,3-benzodioxol-5-ylamino)methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1/C(=C/Nc2ccc3c(c2)OCO3)/c2ccccc2C(=O)N1c1cccc(c1)C(F)(F)F

STK572043
Synonyms: 1,3-dimethyl-7-(4-methylbenzyl)-8-(piperidin-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)Cn1c(CN2CCCCC2)nc2c1c(=O)n(C)c(=O)n2C

STK572044
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK572045
Synonyms: (3a'S,6a'R)-5-bromo-5'-tert-butyl-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(C)(C)C)C(=O)Nc1c2cc(Br)cc1

STK572046
Synonyms: N-(3,4-dimethylphenyl)-2-(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Smiles: O=C(CN1CCc2c(C1C)cc1c(c2)OCCCO1)Nc1ccc(c(c1)C)C

STK572048
Synonyms: methyl4-[(3E)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-4,5-dioxo-1-(1,3-thiazol-2-yl)pyrrolidin-2-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nccs1

STK572049
Synonyms: 8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(CN2CCN(CC2)c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C

STK572050
Synonyms: 2-ethyl-N-[(2E)-3-(2-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]butanamide
Smiles: CCC(C(=O)/N=C\1/SC2C(N1Cc1ccccc1OC)CS(=O)(=O)C2)CC

STK572051
Synonyms: 8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK572053
Synonyms: 2-chloro-N-[(2E)-5-{[2-oxo-2-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethyl]sulfanyl}-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: Clc1ccccc1C(=O)/N=c/1\[nH]nc(s1)SCC(=O)n1c2CCCCc2c2c1cccc2

STK572054
Synonyms: N-(2,4-dimethoxyphenyl)-2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1ccc(cc1OC)OC

STK572055
Synonyms: (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-(3-methylbutoxy)phenyl]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CC(CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nccs1)C

STK572056
Synonyms: 7-(2,4-dichlorobenzyl)-8-(4-ethylpiperazin-1-yl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1Cl)Cl)c(O)nc(=O)n2C

STK572058
Synonyms: 5-[(2E)-3-(4-ethoxyphenyl)prop-2-enoyl]-2,6-dihydroxy-3-(prop-2-en-1-yl)pyrimidin-4(3H)-one
Smiles: C=CCn1c(O)nc(c(c1=O)C(=O)/C=C/c1ccc(cc1)OCC)O

STK572059
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(2-fluorophenyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccccc1F

STK572061
Synonyms: 4-({(E)-[4-(benzyloxy)phenyl]methylidene}amino)-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)OCc1ccccc1

STK572062
Synonyms: (2E)-1-(4-phenoxyphenyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Smiles: O=C(c1ccc(cc1)Oc1ccccc1)/C=C\1/NCCc2c1cc1OCCCOc1c2

STK572063
Synonyms: 1-(2-benzyl-8-methyl-10-phenyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl)ethanone
Smiles: CC(=O)C1=C(C)Oc2c(C1c1ccccc1)c1nc(nn1cn2)Cc1ccccc1

STK572065
Synonyms: 2,2'-{[2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl]imino}diethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C(C)C)CCO

STK572066
Synonyms: 1,3-dimethyl-7-(4-methylbenzyl)-8-[(4-methylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)C)c(=O)n(c(=O)n2C)C

STK572068
Synonyms: N-[2-(4-tert-butylphenyl)-5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]propanamide
Smiles: CCC(=O)Nc1cc(O)nc2n1nc(n2)c1ccc(cc1)C(C)(C)C

STK572069
Synonyms: 5-{[(2Z)-3-(2-chlorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)/N=C/1\SC2C(N1Cc1ccccc1Cl)CS(=O)(=O)C2

STK572070
Synonyms: 1-(3,4-dichlorophenyl)-7-fluoro-2-(6-methylpyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1cccc(n1)N1C(=O)c2c(C1c1ccc(c(c1)Cl)Cl)c(=O)c1c(o2)ccc(c1)F

STK572071
Synonyms: (3a'S,6a'R)-5'-tert-butyl-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(C)(C)C)C(=O)Nc1c2cc(Cl)cc1

STK572072
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(4-hydroxy-3-methoxyphenyl)-5-propyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: CCCN1C(=O)c2c(C1c1ccc(c(c1)OC)O)c([nH]n2)c1cc(Cl)c(cc1O)C

STK572073
Synonyms: 3-methylbutyl[4-(dimethylamino)phenyl][hydroxy(4-methoxyphenyl)methyl]phosphinate
Smiles: COc1ccc(cc1)C(P(=O)(c1ccc(cc1)N(C)C)OCCC(C)C)O

STK572074
Synonyms: 6-(pyridin-2-ylmethyl)-2-sulfanyl-1-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(S)n(c2c1CN(CN2)Cc1ccccn1)c1cccc(c1)C(F)(F)F

STK572076
Synonyms: N-(2-bromo-4-methylphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2Br)C)nnc1c1ccccn1

STK572078
Synonyms: (5E)-5-[(1-ethyl-1H-indol-3-yl)methylidene]-3-(4-ethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cn(c3c2cccc3)CC)/C1=O)O

STK572079
Synonyms: 6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yltrans-4-{[(tert-butoxycarbonyl)amino]methyl}cyclohexanecarboxylate
Smiles: O=C(OC(C)(C)C)NC[C@@H]1CC[C@H](CC1)C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl

STK572080
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-(2-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)c1ccccc1

STK572081
Synonyms: 2-ethyl-3-methyl-1-[2-(quinoxalin-6-ylmethylidene)hydrazinyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1ccc3c(c1)nccn3)c1ccccc1n2

STK572083
Synonyms: 4-(3-chlorophenyl)-8-methyl-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: CN1CCc2c(C1)sc1c2c(=O)n(c2n1cnn2)c1cccc(c1)Cl

STK572084
Synonyms: 2-hydroxy-7-phenyl-1-(pyridin-2-ylmethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Oc1nc(=O)c2c(n1Cc1ccccn1)NC(=NC2(C(F)(F)F)C(F)(F)F)c1ccccc1

STK572085
Synonyms: 4-(4-chlorophenyl)-N-(3-methylphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Clc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)C)c1ccccc1

STK572086
Synonyms: 2-(2-chlorophenyl)-5,10,10-trimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccccc1c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2

STK572088
Synonyms: 1-(3-methoxy-4-propoxyphenyl)-2-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCCOc1ccc(cc1OC)C1N(C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK572089
Synonyms: 4-[(E)-[2-(4-bromophenyl)-1-(3-methoxypropyl)-4,5-dioxopyrrolidin-3-ylidene](hydroxy)methyl]-N,N-dimethylbenzenesulfonamide
Smiles: COCCCN1C(c2ccc(cc2)Br)/C(=C(/c2ccc(cc2)S(=O)(=O)N(C)C)\O)/C(=O)C1=O

STK572092
Synonyms: 2-({[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1H-benzimidazole
Smiles: C=CCn1c(SCc2nc3c([nH]2)cccc3)nnc1c1cccc(c1)Cl

STK572093
Synonyms: N-(3-chlorophenyl)-2-{[4-(4-chlorophenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK572094
Synonyms: 2-{[4-(furan-2-ylmethyl)-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(n1Cc1ccco1)Cc1cccs1

STK572097
Synonyms: (5E)-5-{[1-(2,4-dichlorobenzyl)-1H-indol-3-yl]methylidene}-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(c(c1)Cl)Cn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccco1)O

STK572098
Synonyms: 5-(3,4-dichlorophenyl)-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1)Cl)Cl)N/N=C/C=C/c1ccccc1

STK572100
Synonyms: N-[2-(cyclohex-1-en-1-yl)ethyl]-5,6-dimethoxy-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)NCCC1=CCCCC1

STK572101
Synonyms: 2-{[5-(2-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1nnc(n1Cc1ccco1)c1ccccc1Cl

STK572103
Synonyms: N-(3-chloro-4-fluorophenyl)-5,6-dimethoxy-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)Nc1ccc(c(c1)Cl)F

STK572105
Synonyms: 7-(4-chlorobenzyl)-6-hydroxy-3-methyl-8-[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]-3,7-dihydro-2H-purin-2-one
Smiles: CC(=C)CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)Cl)c(O)nc(=O)n2C

STK572106
Synonyms: N-(2-methoxyphenyl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK572107
Synonyms: N-(3-chloro-4-fluorophenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)F)nnc1COc1ccc(cc1)C

STK572108
Synonyms: 3-(2-methoxyethyl)-8-(2-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COCCn1c(=O)c2n3CCN(c3nc2n(c1=O)C)c1ccccc1OC

STK572110
Synonyms: (4Z)-2-(4-methoxyphenyl)-4-[2-(4-methoxyphenyl)-4H-chromen-4-ylidene]-1,3-oxazol-5(4H)-one
Smiles: COc1ccc(cc1)C1=N/C(=C\2/C=C(Oc3c2cccc3)c2ccc(cc2)OC)/C(=O)O1

STK572111
Synonyms: (2E)-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-3-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)/N=c\2/sc3c([nH]2)cccc3)ccc1OCc1ccc(cc1)Cl

STK572114
Synonyms: (5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)[4-(4-fluorophenyl)piperazin-1-yl]methanone
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)c1nn2c(n1)nc(cc2C)C

STK572115
Synonyms: 2-(2-chloro-6-fluorophenyl)-N-[(2Z)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccccc1)CS(=O)(=O)C2)Cc1c(F)cccc1Cl

STK572116
Synonyms: 4-(4-chlorophenyl)-1-(4-fluorophenyl)-N-(3-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Fc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)C)n2c3c1CCCCn3c(c2)c1ccc(cc1)Cl

STK572117
Synonyms: 7-propyl-14H-thiochromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-14-one
Smiles: CCCc1nc2sc3ccccc3c(=O)c2c2n1c1ccccc1n2

STK572118
Synonyms: 4-[(4-chlorophenyl)carbonyl]-2-(2-methoxy-4-nitrophenyl)hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione
Smiles: COc1cc(ccc1N1C(=O)C2C(C1=O)C1N(C2C(=O)c2ccc(cc2)Cl)CCC1)[N+](=O)[O-]

STK572119
Synonyms: 6-propyl-1-(pyridin-3-ylmethyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2Cc1cccnc1)S

STK572121
Synonyms: 7-butyl-8-[(2-ethylpiperidin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCn1c(CN2CCCCC2CC)nc2c1c(=O)n(c(=O)n2C)C

STK572122
Synonyms: 3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CCn1nnc2c(c1=O)cccc2

STK572123
Synonyms: (3a'S,6a'R)-5'-(4-acetylphenyl)-3'-(1H-indol-3-ylmethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2

STK572124
Synonyms: 2-{5-[(4-methoxybenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazol-3-yl}pyrazine
Smiles: COc1ccc(cc1)CSc1nnc(n1c1ccccc1)c1cnccn1

STK572126
Synonyms: (4E)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCCC(C)C)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O

STK572127
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dichlorophenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1Cl)Cl

STK572129
Synonyms: 2-[(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)amino]butan-1-ol
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NC(CO)CC

STK572130
Synonyms: 3-[(4-chlorobenzyl)oxy]-1-hydroxy-5-methyl-9H-xanthen-9-one
Smiles: Clc1ccc(cc1)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK572131
Synonyms: (1'R,2'R)-7'-chloro-2'-(4-methylphenyl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Cc1ccc(cc1)[C@H]1[C@H](C(=O)c2cccs2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl

STK572132
Synonyms: 2-({[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1H-benzimidazole
Smiles: CCOc1ccc(cc1)n1c(SCc2nc3c([nH]2)cccc3)nnc1c1cccc(c1)C

STK572138
Synonyms: 4-{[(2-methoxyethyl)amino]methyl}quinolin-2-ol
Smiles: COCCNCc1cc(O)nc2c1cccc2

STK572139
Synonyms: 3-chloro-N-[3-(1H-tetrazol-1-yl)phenyl]-1-benzothiophene-2-carboxamide
Smiles: O=C(c1sc2c(c1Cl)cccc2)Nc1cccc(c1)n1cnnn1

STK572141
Synonyms: 2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethyl-6-methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2CC)nnc1c1ccccc1Cl

STK572143
Synonyms: 4-({S-benzyl-N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-L-cysteinyl}amino)butanoicacid
Smiles: O=C(N[C@H](C(=O)NCCCC(=O)O)CSCc1ccccc1)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C

STK572144
Synonyms: 3-[4-(morpholin-4-ylmethyl)phenyl]-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one
Smiles: O=c1oc2c3CN(COc3ccc2c2c1CCC2)c1ccc(cc1)CN1CCOCC1

STK572146
Synonyms: N-[4-(acetylamino)phenyl]-2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nnc1c1cccc(c1)Cl

STK572147
Synonyms: (3-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-1-yl)aceticacid
Smiles: C=CCN1C(=NC(=O)/C(=C\c2cn(c3c2cccc3)CC(=O)O)/C1=O)S

STK572149
Synonyms: N-[3-(2-fluorophenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]-2-methylbenzamide
Smiles: Cc1ccccc1C(=O)Nc1c(c2ccccc2F)c(=O)c2c(n1C)cccc2

STK572150
Synonyms: N-(3-fluoro-4-methylphenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1c1ccccc1)c1ccccn1

STK572152
Synonyms: 4-hydroxy-1,6,7-trimethyl-8-(prop-2-en-1-yl)-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: C=CCn1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK572154
Synonyms: methyl4,5-dimethoxy-2-{[(6-methyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}benzoate
Smiles: COC(=O)c1cc(OC)c(cc1NC(=O)C1OC(=O)c2c(C1)cc(cc2)C)OC

STK572156
Synonyms: 2-[(2-chlorobenzyl)sulfanyl]-9-(3-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Oc1cccc(c1)C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1ccccc1Cl

STK572157
Synonyms: 5,11-dimethyl-2-(pyridin-4-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC1CCCc2c1c1c(s2)nc(n2c1nc(n2)c1ccncc1)C

STK572158
Synonyms: 3-[4-(azepan-1-yl)-4-oxobutyl]-1,2,3-benzotriazin-4(3H)-one
Smiles: O=C(N1CCCCCC1)CCCn1nnc2c(c1=O)cccc2

STK572161
Synonyms: N-(2-fluorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1ccccc1F

STK572162
Synonyms: 6'-amino-3',7-dimethyl-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cccc1C)c(C)n[nH]2

STK572164
Synonyms: N-{3-cyclohexyl-3-[4-(propan-2-yloxy)phenyl]propyl}thiophene-2-carboxamide
Smiles: CC(Oc1ccc(cc1)C(C1CCCCC1)CCNC(=O)c1cccs1)C

STK572165
Synonyms: methyl5-amino-6-cyano-2-methyl-7-(2,4,5-trimethoxyphenyl)-7H-thieno[3,2-b]pyran-3-carboxylate
Smiles: N#CC1=C(N)Oc2c(C1c1cc(OC)c(cc1OC)OC)sc(c2C(=O)OC)C

STK572166
Synonyms: 3-[(4-butylphenyl)amino]-6,7-dimethoxy-2-benzofuran-1(3H)-one
Smiles: CCCCc1ccc(cc1)NC1OC(=O)c2c1ccc(c2OC)OC

STK572167
Synonyms: (6E)-6-[(3,4-dichlorophenyl)imino]-4-(3-methyl-1-benzofuran-2-yl)-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: Nc1[nH]/c(=N\c2ccc(c(c2)Cl)Cl)/nc(n1)c1oc2c(c1C)cccc2

STK572169
Synonyms: 3-[(4-tert-butylbenzyl)sulfanyl]-5-(2-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Smiles: COc1ccccc1c1nnc(n1c1ccccc1)SCc1ccc(cc1)C(C)(C)C

STK572170
Synonyms: N-benzyl-2-{[9-(methylsulfanyl)-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]sulfanyl}acetamide
Smiles: CSc1nc(SCC(=O)NCc2ccccc2)c2c(n1)c1c(s2)nc(c2c1CCC2)C(C)C

STK572171
Synonyms: (4E)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCCC(C)C)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK572172
Synonyms: 2-[4-(difluoromethoxy)-3-methoxyphenyl]-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc(OC)c(c1)OC)c1ccc(c(c1)OC)OC(F)F

STK572174
Synonyms: 3-(1,3-dioxolan-2-yl)-7-oxabicyclo[4.1.0]heptane
Smiles: C1COC(O1)C1CCC2C(C1)O2

STK572175
Synonyms: N-(4-chloro-2-methylphenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)Cl)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1

STK572177
Synonyms: 2-[(3S,3'S,3a'R,6a'S)-7-chloro-2,4',6'-trioxo-5'-(tetrahydrofuran-2-ylmethyl)-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)C[C@@H]1N[C@]2([C@@H]3[C@H]1C(=O)N(C3=O)CC1CCCO1)C(=O)Nc1c2cccc1Cl

STK572178
Synonyms: 2-[bis(2-hydroxypropyl)amino]-3-(4-chlorophenyl)-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CC(CN(c1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCN(C3)C)CC(O)C)O

STK572180
Synonyms: 2-{1,3-dimethyl-8-[(3-methylpiperidin-1-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetamide
Smiles: CC1CCCN(C1)Cc1nc2c(n1CC(=O)N)c(=O)n(c(=O)n2C)C

STK572181
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(furan-2-ylmethyl)-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1Cc1ccco1

STK572182
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK572183
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C)nnc1COc1ccccc1

STK572184
Synonyms: 5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1,3-diphenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Cc1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1

STK572185
Synonyms: N-[(2Z)-5,5-dioxido-3-(prop-2-en-1-yl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclopropanecarboxamide
Smiles: C=CCN1/C(=N/C(=O)C2CC2)/SC2C1CS(=O)(=O)C2

STK572186
Synonyms: 6-[(2E)-2-(3,4-dimethoxybenzylidene)-1-ethylhydrazinyl]-2-hydroxy-3-methylpyrimidin-4(3H)-one
Smiles: CCN(c1cc(=O)n(c(n1)O)C)/N=C/c1ccc(c(c1)OC)OC

STK572187
Synonyms: [(benzylamino)(phenyl)methyl]phosphinicacid
Smiles: OP(=O)C(c1ccccc1)NCc1ccccc1

STK572189
Synonyms: N-(3-chlorophenyl)-2-[(12-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]acetamide
Smiles: CC1CCc2c(C1)c1c(s2)n2c(SCC(=O)Nc3cccc(c3)Cl)nnc2n2c1ncn2

STK572190
Synonyms: 9-cyclopropyl-3,4-dimethyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: Cc1c2ccc3c(c2oc(=O)c1C)CN(CO3)C1CC1

STK572191
Synonyms: 3,4-dimethoxy-N-[(2Z)-4-(4-methylphenyl)-1,3-thiazol-2(3H)-ylidene]benzamide
Smiles: COc1cc(ccc1OC)C(=O)/N=c/1\scc([nH]1)c1ccc(cc1)C

STK572192
Synonyms: N-[3-(dimethylamino)propyl]-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CN(CCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2)C

STK572193
Synonyms: N-[3-(2-fluorophenyl)-2',6'-dihydroxy-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl]propanamide
Smiles: CCC(=O)Nc1ccc2c(c1)CC1(C3N2CCN(C3)c2ccccc2F)C(=NC(=NC1=O)O)O

STK572196
Synonyms: methylN-(cyclopentylcarbamoyl)-D-methioninate
Smiles: COC(=O)[C@H](NC(=O)NC1CCCC1)CCSC

STK572197
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(3-methoxyphenyl)carbonyl]-3'-[(4-methylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK572200
Synonyms: N-[(2Z)-3-(3-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclopropanecarboxamide
Smiles: Fc1cccc(c1)N1/C(=N/C(=O)C2CC2)/SC2C1CS(=O)(=O)C2

STK572201
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4-dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK572202
Synonyms: 9'-fluoro-1-[2-(4-methoxyphenyl)ethyl]-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: COc1ccc(cc1)CCN1C(=O)NC(=O)C2(C1=O)Cc1cccc(c1N1C2CCC1)F

STK572203
Synonyms: N-[2-(furan-2-yl)-2-(pyrrolidin-1-yl)ethyl]-3,5,6-trimethyl-1-benzofuran-2-carboxamide
Smiles: Cc1cc2c(cc1C)oc(c2C)C(=O)NCC(c1ccco1)N1CCCC1

STK572208
Synonyms: N-(4-methoxyphenyl)-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: COc1ccc(cc1)NC(=O)CCCn1cnc2c(c1=O)cccc2

STK572211
Synonyms: 1-hydroxy-9-oxo-9H-xanthen-3-ylN-(tert-butoxycarbonyl)-D-valinate
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1)C(C)C

STK572212
Synonyms: N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-5,6-dimethoxy-1H-indole-2-carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2cc3c([nH]2)cc(c(c3)OC)OC)cccc1OC

STK572213
Synonyms: 2-ethyl-3-propyl-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: CCCn1c(CC)nc2c(c1=O)c(=O)c1c(s2)cccc1

STK572214
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(3-methoxyphenyl)carbonyl]-3'-(pyridin-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccn2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK572215
Synonyms: 8-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-7-(2-methoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK572217
Synonyms: 8-(3-methoxypropyl)-1,6,7-trimethyl-3-(2-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCCn1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCc1ccccc1

STK572218
Synonyms: 6-chloro-3,4-dimethyl-9-(pyridin-3-ylmethyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: Clc1cc2c(c3c1OCN(C3)Cc1cccnc1)oc(=O)c(c2C)C

STK572219
Synonyms: methylN-[(Z)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C\1/C(=NC(=NC1=O)S)O

STK572220
Synonyms: N-(2,5-dimethylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK572222
Synonyms: 4-(4-ethoxy-2-nitrophenyl)-5-(quinolin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(c(c1)[N+](=O)[O-])n1c(=S)[nH]nc1c1ccc2c(n1)cccc2

STK572224
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)Cl)OC)nnc1c1cccc(c1)OC

STK572225
Synonyms: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(biphenyl-2-yl)acetamide
Smiles: O=C(Nc1ccccc1c1ccccc1)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK572226
Synonyms: 3-(3-chlorophenyl)-2-[(3-hydroxypropyl)amino]-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: OCCCNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C

STK572227
Synonyms: N-[(3Z)-6-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-nitrobenzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])/c2c1nc1ccc(cc1c2)C

STK572229
Synonyms: 2-{[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone
Smiles: Cc1ccc(cc1)C(=O)CSc1nnc(n1N)c1n[nH]c(c1)C

STK572230
Synonyms: 3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl(3,4,5-trimethoxyphenyl)methanone
Smiles: COc1cc(cc(c1OC)OC)C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK572233
Synonyms: ethyl4-[1-methyl-2,4-dioxo-3-(3-phenylpropyl)-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)CCCc1ccccc1

STK572234
Synonyms: 1-(4-chlorophenyl)-2-(4-methoxybenzyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1)CN1C(=O)c2c(C1c1ccc(cc1)Cl)c(=O)c1c(o2)cccc1

STK572237
Synonyms: 7'-[(Z)-(1-heptyl-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)-trione
Smiles: CCCCCCCN1C(=O)N=C(/C(=C/c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK572238
Synonyms: 2-[4-(2-chloro-5-methylphenoxy)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Oc2cc(C)ccc2Cl)c2c(n1)cccc2

STK572240
Synonyms: N-[5-chloro-2-(1H-1,2,4-triazol-1-yl)phenyl]-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1n1ncnc1)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK572245
Synonyms: 16-(3-bromophenyl)-2,3,4,6,7,11,12,16-octahydro-1H,10H-[1,4]dioxepino[2',3':6,7]isoquino[2,1-a]quinolin-1-one
Smiles: Brc1cccc(c1)C1C=C2N(C3=C1C(=O)CCC3)CCc1c2cc2OCCCOc2c1

STK572247
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(nnc1SCC(=O)N)COc1ccc(cc1)Cl

STK572248
Synonyms: 2,2-dimethyl-5-(propan-2-yl)-N-(tetrahydrofuran-2-ylmethyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CC(c1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCC1CCCO1)C

STK572249
Synonyms: 2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(3-methoxypropyl)acetamide
Smiles: COCCCNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)F

STK572254
Synonyms: 2-(8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Smiles: NC(=O)Cn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK572257
Synonyms: 5-[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-2,6-dihydroxy-3-phenylpyrimidin-4(3H)-one
Smiles: O=C(c1c(O)nc(n(c1=O)c1ccccc1)O)/C=C/c1ccc2c(c1)OCO2

STK572258
Synonyms: 9-(4-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)C2c1ccc(cc1)Cl

STK572259
Synonyms: 7-methyl-10-(tetrahydrofuran-2-ylmethyl)-1,2,3,4,10,11-hexahydro-5H,9H-benzo[3,4]chromeno[6,7-e][1,3]oxazin-5-one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c2c1CCCC2)CC1CCCO1

STK572262
Synonyms: N-(azepan-1-ylcarbonyl)-D-leucine
Smiles: CC(C[C@H](C(=O)O)NC(=O)N1CCCCCC1)C

STK572263
Synonyms: 5-methyl-N-(2-phenylethyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: O=C(c1nn2c(n1)c1c(nc2C)sc2c1CCC2)NCCc1ccccc1

STK572264
Synonyms: 7-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1-(3,4,5-trimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(cc(c1OC)OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)CC

STK572265
Synonyms: 2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1COc1ccc(cc1)C

STK572269
Synonyms: 7'-{(E)-[1-(2-ethoxyphenyl)-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: CCOc1ccccc1N1C(=O)N=C(/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK572270
Synonyms: N-(4-{methyl[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]sulfamoyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N(Cc1cc2ccccc2[nH]c1=O)C

STK572271
Synonyms: N-{[(3S)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]carbonyl}-D-leucine
Smiles: CC(C[C@H](C(=O)O)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

STK572272
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)c1ccccc1

STK572273
Synonyms: 2-[(3a'S,6a'R)-5-fluoro-2,4',6'-trioxo-5'-(2-phenylethyl)-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)CCc1ccccc1)C(=O)Nc1c2cc(F)cc1

STK572277
Synonyms: 2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1Cl

STK572278
Synonyms: 1-(4-ethoxy-3-methoxyphenyl)-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1OC)C1N(c2sc3c(n2)ccc(c3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK572279
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl[2-(3-ethoxyphenyl)-4,5-dioxo-1-(pyridinium-4-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1Cc1cc[nH+]cc1

STK572280
Synonyms: 7-(2-chlorophenyl)-3-(3-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Cc1cccc(c1)c1nnc2n1cnc1c2cnn1c1ccccc1Cl

STK572281
Synonyms: N-(5-chloro-2-methylphenyl)-2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK572282
Synonyms: (2S)-N-(3-chlorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: Clc1cccc(c1)NC(=O)[C@@H](n1cnc2c(c1=O)cccc2)C

STK572283
Synonyms: 6-hydroxy-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-[(2E)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-2H-purin-2-one
Smiles: COc1ccc(cc1)CCn1c(N/N=C\2/C(=O)Nc3c2cccc3)nc2c1c(O)nc(=O)n2C

STK572286
Synonyms: 6'-chloro-1-(propan-2-yl)-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CC(N1C(=O)NC(=O)C2(C1=O)Cc1c(Cl)cccc1N1C2CCC1)C

STK572287
Synonyms: N-[4-(3-methoxyphenyl)-6-methyl-2-(4-methylphenyl)-5-oxo-2,5-dihydropyridazin-3-yl]benzamide
Smiles: COc1cccc(c1)c1c(=O)c(C)nn(c1NC(=O)c1ccccc1)c1ccc(cc1)C

STK572289
Synonyms: N-(3-chlorophenyl)-2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK572292
Synonyms: N-(4-chlorophenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK572294
Synonyms: N-[(2Z)-3-(3,4-dimethylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: CC(=O)/N=C/1\SC2C(N1c1ccc(c(c1)C)C)CS(=O)(=O)C2

STK572295
Synonyms: (2Z)-1-(2,6-dichloropyridin-4-yl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Smiles: Clc1nc(Cl)cc(c1)C(=O)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK572296
Synonyms: 6,7-dimethoxy-N-(propan-2-yl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Smiles: COc1cc2CN(CCc2cc1OC)C(=S)NC(C)C

STK572297
Synonyms: 3-(benzylsulfanyl)-5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)n1c(SCc2ccccc2)nnc1c1cccc(c1)Cl

STK572299
Synonyms: 5-(3-methylphenyl)-4-({(E)-[4-(pentyloxy)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCCCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK572300
Synonyms: 2-(furan-2-yl)-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)c1ccco1)C

STK572301
Synonyms: N-[(1Z)-1-{1-cyano-2-[(3-methylbutyl)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)NCCC(C)C

STK572303
Synonyms: 6-cyclohexyl-1-(4-methylphenyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)C1CCCCC1

STK572304
Synonyms: N-(3,4-diethoxyphenyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Smiles: CCOc1cc(ccc1OCC)NC(=O)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK572305
Synonyms: 2-{[2-(3-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: COc1cccc(c1)c1nc(SCC(=O)N(c2ccccc2)c2ccccc2)c2c(n1)CC(OC2)(C)C

STK572307
Synonyms: 2-{[8,8-dimethyl-11-(morpholin-4-yl)-7,10-dihydro-8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc2n1cnc1c2sc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK572308
Synonyms: 8-[benzyl(methyl)amino]-6-hydroxy-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-2H-purin-2-one
Smiles: O=c1nc(O)c2c(n1C)nc(n2CCSc1nnnn1c1ccccc1)N(Cc1ccccc1)C

STK572310
Synonyms: 2-(6-ethyl-1,3-benzothiazol-2-yl)-1-(4-hydroxy-3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(c(c1)OC)O)c(=O)c1c(o2)cccc1

STK572311
Synonyms: N-(3-bromophenyl)-2-({5-[(4-chlorophenoxy)methyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1cccc(c1)Br)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK572312
Synonyms: N-[(2E)-4-(4-bromophenyl)-1,3-thiazol-2(3H)-ylidene]-3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanamide
Smiles: Brc1ccc(cc1)c1cs/c(=N/C(=O)CCn2c(=O)sc3c2cccc3)/[nH]1

STK572313
Synonyms: 4-hydroxy-8-(2-hydroxyethyl)-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: OCCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK572317
Synonyms: 4-[(2,2-dimethoxyethyl)sulfanyl]-6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: COC(CSc1nc(SC)nc2c1c1CC(C)(C)OCc1s2)OC

STK572318
Synonyms: 2-(2-chlorophenyl)-3-cyclohexyl-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: Cn1c2nc(c3ccccc3Cl)n(c(=O)c2c(=O)c2c1cccc2)C1CCCCC1

STK572319
Synonyms: 2-ethyl-4-(4-methylpiperazin-1-yl)[1]benzofuro[3,2-d]pyrimidine
Smiles: CCc1nc(N2CCN(CC2)C)c2c(n1)c1ccccc1o2

STK572320
Synonyms: 2,4-dichloro-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)c1ccc(cc1Cl)Cl)c1ccccc1

STK572321
Synonyms: 3-[(4-methoxybenzyl)sulfanyl]-4-methyl-5-(3-methylphenyl)-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)CSc1nnc(n1C)c1cccc(c1)C

STK572322
Synonyms: 2-{methyl[5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinolin-8-yl]amino}ethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C)C

STK572323
Synonyms: N-(3,4-difluorophenyl)quinoxaline-6-carboxamide
Smiles: O=C(c1ccc2c(c1)nccn2)Nc1ccc(c(c1)F)F

STK572325
Synonyms: (3R)-N-{(2S)-1-[(2-methoxyethyl)amino]-3-methyl-1-oxobutan-2-yl}-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: COCCNC(=O)[C@H](C(C)C)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

STK572327
Synonyms: 8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-7-(2-ethoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCOCCn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK572328
Synonyms: 2-[(4-bromophenyl)sulfonyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)S(=O)(=O)c1ccc(cc1)Br

STK572329
Synonyms: 2-cyclohexyl-3-(furan-2-ylmethyl)-8-methoxy-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)c(=O)n(c(n1)C1CCCCC1)Cc1ccco1

STK572330
Synonyms: 5,7-dichloro-2-(5-methyl-1,2-oxazol-3-yl)-1-(2,3,4-trimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(c(c1OC)OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c(Cl)cc(c1)Cl

STK572332
Synonyms: 6,6-dimethyl-9-[4-(methylsulfanyl)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)(C)C

STK572333
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1cccnc1

STK572335
Synonyms: 2-{[4-(bicyclo[2.2.1]hept-2-yl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}phthalazin-1(2H)-one
Smiles: O=c1n(ncc2c1cccc2)Cc1n[nH]c(=S)n1C1CC2CC1CC2

STK572336
Synonyms: N-[4-(diethylamino)phenyl]-2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)Cc1cccs1)CC

STK572341
Synonyms: 3-(biphenyl-4-yloxy)-4-oxo-8-(piperidinium-1-ylmethyl)-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCCC1)oc(c(c2=O)Oc1ccc(cc1)c1ccccc1)C(F)(F)F

STK572344
Synonyms: 2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(pyridin-2-ylmethyl)acetamide
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)NCc1ccccn1

STK572345
Synonyms: (1E,2E)-1-{2-(3,4-dimethoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}-3-phenylprop-2-en-1-olate
Smiles: COc1ccc(cc1OC)C1/C(=C(/C=C/c2ccccc2)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STK572346
Synonyms: 8-(4-chlorophenyl)-1,6,7-trimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(cc1)n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCCCC1

STK572347
Synonyms: (4E)-5-(3-bromophenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Br)c1nnc(s1)C)/O

STK572348
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-3-[4-(benzyloxy)phenyl]-6-(pyridin-3-ylmethyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: O=C1N(Cc2cccnc2)C(=O)[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2c1ccc(cc1)OCc1ccccc1

STK572349
Synonyms: (2E)-3-(4-chlorophenyl)-N-[7-(4-chlorophenyl)-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]prop-2-enamide
Smiles: Clc1ccc(cc1)/C=C/C(=O)Nc1nn2c(=NC(=CC2c2ccc(cc2)Cl)c2ccccc2)[nH]1

STK572350
Synonyms: N-[(2E)-4,6-dichloro-1,3-benzothiazol-2(3H)-ylidene]-4-hydroxy-1-octyl-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCCCCCn1c(=O)c(C(=O)/N=c\2/sc3c([nH]2)c(Cl)cc(c3)Cl)c(c2c1cccc2)O

STK572352
Synonyms: methylN-{(1Z)-1-[1-(4-chlorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]ethyl}tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/C

STK572353
Synonyms: 1',3,3'-trimethyl-8-[(E)-(2,4,6-trioxo-1-propyltetrahydropyrimidin-5(2H)-ylidene)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: CCCN1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=O)N(C)C(=O)N(C2=O)C)/C1=O

STK572354
Synonyms: (1'S,3R,3'S,7a'S)-5''-ethyl-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: CCc1ccc2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccs1

STK572357
Synonyms: N-[3-(4-fluorophenyl)-4-oxo-4H-thiochromen-2-yl]furan-2-carboxamide
Smiles: Fc1ccc(cc1)c1c(NC(=O)c2ccco2)sc2c(c1=O)cccc2

STK572358
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-2-(4-hydroxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccccc2)/[O-])/C1c1ccc(c(c1)OC)O)CC

STK572359
Synonyms: (3a'S,6a'R)-5-chloro-5'-cyclopentyl-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)C1CCCC1)C(=O)Nc1c2cc(Cl)cc1

STK572360
Synonyms: (5Z)-6-hydroxy-5-{[5-(4-methylpiperazin-1-yl)furan-2-yl]methylidene}-2-sulfanylpyrimidin-4(5H)-one
Smiles: CN1CCN(CC1)c1ccc(o1)/C=C\1/C(=NC(=NC1=O)S)O

STK572361
Synonyms: 1-(2,8-dimethyl-10-phenyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl)ethanone
Smiles: Cc1nn2c(n1)c1c(nc2)OC(=C(C1c1ccccc1)C(=O)C)C

STK572362
Synonyms: 8-methyl-N-(2-phenylethyl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-amine
Smiles: CN1CCc2c(C1)sc1c2c(NCCc2ccccc2)nc2n1nnn2

STK572363
Synonyms: 8-[4-(4-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)Cc1ccc(cc1)Cl

STK572364
Synonyms: (10'R,11'R)-10'-(4-methylphenyl)-11'-(phenylcarbonyl)-10',11'-dihydro-8a'H-spiro[indene-2,9'-pyrrolo[1,2-a][1,10]phenanthroline]-1,3-dione
Smiles: Cc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2c2ncccc2cc1

STK572365
Synonyms: N'-[(E)-(3-bromophenyl)methylidene]-2,4-dihydroxyquinoline-3-carbohydrazide
Smiles: Brc1cccc(c1)/C=N/NC(=O)c1c(O)nc2c(c1O)cccc2

STK572366
Synonyms: 3-amino-N-(4-fluorophenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridine-2-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1sc2c(c1N)cc1c(n2)CCCCCC1

STK572367
Synonyms: 3-[(2S)-1-(morpholin-4-yl)-1-oxopropan-2-yl]-1,2,3-benzotriazin-4(3H)-one
Smiles: O=C([C@@H](n1nnc2c(c1=O)cccc2)C)N1CCOCC1

STK572368
Synonyms: (1'S,3R,3'S,7a'R)-6'',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)Nc1c2ccc(c1C)C

STK572369
Synonyms: N-(4-fluorophenyl)-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: O=C(Nc1ccc(cc1)F)CCCn1cnc2c(c1=O)cccc2

STK572370
Synonyms: (3S,3a'R,8a'S,8b'S)-5-chloro-2'-(2,4-dichlorophenyl)-7-methyl-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: Clc1ccc(c(c1)Cl)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2C

STK572371
Synonyms: 8,8-dimethyl-3-[(3-methylbutyl)sulfanyl]-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCCC(C)C)nnc2c2c1CC(C)(C)OC2

STK572372
Synonyms: (4E)-1-butyl-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(c(c1)OC)O

STK572373
Synonyms: 4-({(2'S,3S,3'S,10b'R)-2'-[(4-fluorophenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl}carbonyl)phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)F)C(=O)Nc1c2cccc1)cccc3

STK572374
Synonyms: 2-{[7,7-dimethyl-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-(furan-2-ylmethyl)acetamide
Smiles: O=C(NCc1ccco1)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C

STK572376
Synonyms: 9-(3-chlorophenyl)-10-{[3-(dimethylamino)propyl]amino}-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Smiles: CN(CCCNc1nc2c3c(sc2c(=O)n1c1cccc(c1)Cl)nc(c1c3CC(C)(C)OC1)C)C

STK572377
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-(3,4-dichlorophenyl)acetamide
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)Nc3ccc(c(c3)Cl)Cl)nnc2c2c1CC(C)(C)OC2

STK572378
Synonyms: N-(4-{(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxo-2-phenylpyrrolidin-1-yl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1ccccc1

STK572379
Synonyms: 4-{[(E)-(4-ethoxy-3-methoxyphenyl)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(c(c1)OC)OCC

STK572380
Synonyms: N-[(2E)-3-(4-fluorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: Fc1ccc(cc1)CN1/C(=N\C(=O)C)/SC2C1CS(=O)(=O)C2

STK572381
Synonyms: N-(2-ethyl-6-methylphenyl)-2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1Cc1ccco1)c1ccccc1F)C

STK572383
Synonyms: 4-{[(E)-(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1cc(/C=N/n2c(=S)[nH]nc2c2ccncc2)c(c(c1)Br)O

STK572384
Synonyms: 1-(furan-2-ylmethyl)-6-(prop-2-en-1-yl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: C=CCN1CNc2c(C1)c(=O)nc(n2Cc1ccco1)S

STK572385
Synonyms: methylN-{[(3R,5S)-3,5-dimethylpiperidin-1-yl]carbonyl}-L-alaninate
Smiles: COC(=O)[C@@H](NC(=O)N1C[C@H](C)C[C@@H](C1)C)C

STK572388
Synonyms: (4E)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)F)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O

STK572389
Synonyms: N-[(3Z)-1-butyl-8-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-3-methoxypropanamide
Smiles: CCCCn1[nH]/c(=N\C(=O)CCOC)/c2c1nc1c(C)cccc1c2

STK572393
Synonyms: 2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(F)(F)F)nnc1COc1ccccc1

STK572394
Synonyms: (4E)-5-(4-butoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC

STK572396
Synonyms: 3-[(2,6-dichlorobenzyl)sulfanyl]-4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazole
Smiles: CCOc1ccc(cc1)n1c(nnc1SCc1c(Cl)cccc1Cl)COc1ccc(cc1)C

STK572397
Synonyms: 7'-[(Z)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-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)-trione
Smiles: SC1=NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C(=N1)O

STK572398
Synonyms: (3S)-N-{(2S)-1-[(2,4-dimethylphenyl)amino]-4-methyl-1-oxopentan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: CC(C[C@@H](C(=O)Nc1ccc(cc1C)C)NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK572400
Synonyms: N-(5-chloro-2,4-dimethoxyphenyl)-2-[(2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: COc1cc(OC)c(cc1NC(=O)COc1ccc2c(c1)oc(=O)cc2)Cl

STK572401
Synonyms: 4-[4-(benzyloxy)-3-methoxyphenyl]-6-hydroxy-2-(methylsulfanyl)-4,5-dihydropyridine-3-carbonitrile
Smiles: N#CC1=C(SC)N=C(CC1c1ccc(c(c1)OC)OCc1ccccc1)O

STK572404
Synonyms: 3,4,8-trimethyl-2-oxo-2H-chromen-7-ylN-[(4-methylphenyl)sulfonyl]-L-valinate
Smiles: Cc1ccc(cc1)S(=O)(=O)N[C@H](C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)C)C(C)C

STK572406
Synonyms: N-{2-[(4-fluorophenyl)amino]-2-oxoethyl}-1-(L-phenylalanyl)piperidine-4-carboxamide
Smiles: O=C(Nc1ccc(cc1)F)CNC(=O)C1CCN(CC1)C(=O)[C@H](Cc1ccccc1)N

STK572407
Synonyms: 1-(4-bromophenyl)-7-chloro-2-(4-methylpyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Brc1ccc(cc1)C1N(c2nccc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK572408
Synonyms: 3-(3-chlorophenyl)-5-[(2,5-dimethylbenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)n1c(SCc2cc(C)ccc2C)nnc1c1cccc(c1)Cl

STK572409
Synonyms: 2-(4-hydroxy-3-iodo-5-methoxyphenyl)-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: COc1cc2c(cc1OC)CCn1c2cc(c2cc(I)c(c(c2)OC)O)c(c1=N)C#N

STK572410
Synonyms: (1'S,3R,3'S,7a'S)-5''-ethyl-1'-[(3-nitrophenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCc1ccc2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK572411
Synonyms: N-(2-methoxyphenyl)-2-{[2-(3-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nc(SCC(=O)Nc2ccccc2OC)c2c(n1)CC(OC2)(C)C

STK572414
Synonyms: 1'-(2-chlorobenzyl)-2'-hydroxy-13-methyl-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)N1Cc1ccccc1Cl)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C

STK572415
Synonyms: ethyl4-{1,7-dimethyl-2,4-dioxo-3-[2-(piperidin-1-yl)ethyl]-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK572417
Synonyms: (3a'S,6a'R)-5-chloro-3'-[2-(methylsulfanyl)ethyl]-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: CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cc(Cl)cc1

STK572418
Synonyms: (6E)-4-(3-methyl-1-benzofuran-2-yl)-6-[(3-methylphenyl)imino]-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: Cc1cccc(c1)/N=c/1\[nH]c(N)nc(n1)c1oc2c(c1C)cccc2

STK572419
Synonyms: 7-chloro-1',3'-bis(2-methylpropyl)-3-phenyl-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: CC(CN1C(=O)N(CC(C)C)C(=O)C2(C1=O)Cc1c(Cl)cccc1N1C2CN(CC1)c1ccccc1)C

STK572420
Synonyms: 3-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-1,1-dimethylthiourea
Smiles: S=C(N(C)C)/N=c/1\sc2c([nH]1)cccc2

STK572421
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1c1ccc(cc1)Cl)c1cccnc1

STK572422
Synonyms: 3-(butylsulfanyl)-8,8-dimethyl-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Smiles: CCCCSc1nnc2n1c(Nc1ccccc1)c(C#N)c1c2COC(C1)(C)C

STK572423
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluoro-4-methylphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1COc1ccc(cc1)Cl

STK572424
Synonyms: (3a'S,6a'R)-5'-butyl-5-chloro-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: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C)C(=O)Nc2c1cc(Cl)cc2

STK572426
Synonyms: N-(4-butylphenyl)-2-{[3-cyano-5-hydroxy-4-(4-methoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C2=C(CC(CC2=N1)(C)C)O)c1ccc(cc1)OC

STK572427
Synonyms: methylN-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]glycinate
Smiles: COC(=O)CNC(=O)N1CC(=Nc2c1cccc2)O

STK572430
Synonyms: 7'-nitro-1,3-diphenyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1N(c2ccccc2)C(=O)C2(C(=O)N1c1ccccc1)Cc1cc(ccc1N1C2CCC1)[N+](=O)[O-]

STK572431
Synonyms: 7-[(4-chlorobenzyl)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)Cl)nn2

STK572432
Synonyms: 3-(1H-benzimidazol-2-yl)-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: CC(Cn1c2nc3ccccc3nc2c(c1N)c1nc2c([nH]1)cccc2)C

STK572433
Synonyms: N-(1,3-benzodioxol-5-yl)-2-({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1COc1ccc(cc1)C

STK572434
Synonyms: N-[4-({(Z)-[2-(2,4-dimethylphenyl)-1,3-dioxo-2,3-dihydroisoquinolin-4(1H)-ylidene]methyl}amino)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N/C=C\1/c2ccccc2C(=O)N(C1=O)c1ccc(cc1C)C

STK572436
Synonyms: N,N-diethyl-2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CCN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C(C)C)CC

STK572437
Synonyms: (5E)-3-(4-chlorophenyl)-5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C\Nc2c(C)n(n(c2=O)c2ccccc2)C)/C1=O)O

STK572438
Synonyms: N'-[(E)-quinolin-4-ylmethylidene]pyridine-4-carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccnc2c1cccc2

STK572439
Synonyms: methylN-[(2,3-dimethylphenyl)carbamoyl]-D-methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1cccc(c1C)C

STK572440
Synonyms: N-(4-bromophenyl)-2-{[4-(4-methoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Br)nnc1COc1ccccc1

STK572441
Synonyms: N-[(2E)-5-phenyl-1,3,4-thiadiazol-2(3H)-ylidene]-2,1,3-benzothiadiazole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)nsn2)/N=c/1\[nH]nc(s1)c1ccccc1

STK572442
Synonyms: (5E)-1-(3-methylphenyl)-5-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cccc(c1)N1C(=NC(=O)/C(=C\NCCN2CCOCC2)/C1=O)S

STK572443
Synonyms: 1-amino-2-[(2-hydroxyethyl)(methyl)amino]-4-[(4-methoxyphenyl)amino]anthracene-9,10-dione
Smiles: OCCN(c1cc(Nc2ccc(cc2)OC)c2c(c1N)C(=O)c1c(C2=O)cccc1)C

STK572444
Synonyms: 1-[3-(benzyloxy)phenyl]-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1cccc(c1)OCc1ccccc1)c(=O)c1c(o2)cccc1

STK572445
Synonyms: N-(2-methoxybenzyl)-1-({1-[(4-methylphenyl)sulfonyl]piperidin-4-yl}carbonyl)-L-prolinamide
Smiles: COc1ccccc1CNC(=O)[C@@H]1CCCN1C(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

STK572446
Synonyms: 9-(3-chlorophenyl)-3-(4-fluorobenzyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)Cl

STK572447
Synonyms: (3R,3'S,5'S)-7-chloro-N-(4-methoxyphenyl)-5-methyl-5'-(2-methylpropyl)-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1Cl)CC(C)C

STK572449
Synonyms: (5Z)-3-(4-chlorophenyl)-5-[5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(ccc1OC)C1NN/C(=C\2/C(=NC(=O)N(C2=O)c2ccc(cc2)Cl)O)/C1

STK572450
Synonyms: N-(4-chloro-2-methylphenyl)-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)Cl)nnc1c1cccc(c1)C

STK572451
Synonyms: 8-[(Z)-(4-hydroxy-1-methyl-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]-1',3,3'-trimethyl-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: CN1CCN2C(C1)C1(Cc3c2ccc(c3)/C=C\2/C(=NC(=O)N(C2=O)C)O)C(=O)N(C)C(=O)N(C1=O)C

STK572452
Synonyms: [4-(3-chlorophenyl)piperazin-1-yl](5-methoxy-3-methyl-1H-indol-2-yl)methanone
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)N1CCN(CC1)c1cccc(c1)Cl

STK572453
Synonyms: 1-(4-hydroxy-6-methylpyrimidin-2-yl)-3-[3-(trifluoromethyl)phenyl]guanidine
Smiles: N=C(Nc1nc(C)cc(n1)O)Nc1cccc(c1)C(F)(F)F

STK572454
Synonyms: N'-[(1E)-1-(1-benzyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)propyl]pentanehydrazide
Smiles: CCCCC(=O)NN/C(=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O)/CC

STK572455
Synonyms: (5E)-6-hydroxy-3-(2-methylphenyl)-5-[(2-phenyl-1H-indol-3-yl)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/c1c([nH]c2c1cccc2)c1ccccc1)c1ccccc1C

STK572458
Synonyms: 4-(2-methylpropyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-amine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCC2)ncnc3NCCN1CCOCC1)C

STK572460
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(furan-2-ylmethyl)-5-phenylpyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)Cc1ccco1)/O

STK572463
Synonyms: 7-fluoro-2-(6-methylpyridin-2-yl)-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1)c1cccc(n1)C

STK572464
Synonyms: 3-(3-chlorobenzyl)-9-(3-chlorophenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Clc1cccc(c1)Cn1c(=O)c2n3CCCN(c3nc2n(c1=O)C)c1cccc(c1)Cl

STK572467
Synonyms: N-(3-ethoxypropyl)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CCOCCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK572469
Synonyms: (5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-(4-ethoxy-3-methoxybenzylidene)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCOc1ccc(cc1OC)/C=C/1\C(=O)N(C2CCS(=O)(=O)C2)C(=O)C(=C1C)C#N

STK572470
Synonyms: 2'-hydroxy-12-methyl-1'-(2-methylpropyl)-15,16-dihydro-4'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-4',6',7(1'H)-trione
Smiles: CC(CN1C(=NC(=O)C2(C1=O)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C)O)C

STK572471
Synonyms: 1-(1-{6-[bis(2-hydroxyethyl)amino]pyrimidin-4-yl}-5-methyl-1H-pyrazol-4-yl)ethanone
Smiles: OCCN(c1ncnc(c1)n1ncc(c1C)C(=O)C)CCO

STK572472
Synonyms: 6-benzyl-2-hydroxy-1-(3-methylphenyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1cccc(c1)n1c(O)nc(=O)c2c1NCN(C2)Cc1ccccc1

STK572473
Synonyms: ethyl4-[(3a'S,6a'R)-5-fluoro-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]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(F)cc2

STK572474
Synonyms: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-ethyl-6-methylpyrimidin-4-ol
Smiles: CCc1c(C)nc(nc1O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK572478
Synonyms: 6,6-dimethyl-2-(methylsulfanyl)-4-(piperazin-1-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CSc1nc(N2CCNCC2)c2c(n1)sc1c2CC(OC1)(C)C

STK572480
Synonyms: (5E)-5-{[1-(4-bromo-3-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxy-3-(thiophen-2-ylmethyl)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\c2cc(n(c2C)c2ccc(c(c2)C)Br)C)/C(=O)N1Cc1cccs1

STK572482
Synonyms: 3-(3-chlorophenyl)-2-(4-fluorophenyl)-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: Clc1cccc(c1)n1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccc(cc1)F

STK572484
Synonyms: 2-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-5-hydroxy-7-methyl-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc3OCOc3cc1Br)c(O)nc(c2)C

STK572485
Synonyms: 5-{4-[(2-chlorobenzyl)oxy]phenyl}-N'-[(E)-pyridin-2-ylmethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc(cc1)OCc1ccccc1Cl)N/N=C/c1ccccn1

STK572487
Synonyms: 2-[(2,4-dimethylphenyl)amino]-6-methyl-5-pentylpyrimidin-4-ol
Smiles: CCCCCc1c(C)nc(nc1O)Nc1ccc(cc1C)C

STK572488
Synonyms: N-(3-chlorophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]propanamide
Smiles: CCC(=O)N(c1cccc(c1)Cl)/C=C/1\Sc2c(C1=O)cccc2

STK572490
Synonyms: 2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethoxyphenyl)acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1C)c1cccc(c1)Cl

STK572492
Synonyms: 8-(3-chloro-2-methylphenyl)-1,7-dimethyl-3-(2-oxopropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1cccc(c1C)Cl)C

STK572493
Synonyms: (5E)-3-(3-chlorophenyl)-2-hydroxy-5-[(1-phenyl-1H-pyrrol-2-yl)methylidene]-3,5-dihydro-4H-imidazol-4-one
Smiles: Clc1cccc(c1)N1C(=N/C(=C/c2cccn2c2ccccc2)/C1=O)O

STK572494
Synonyms: N-[5-hydroxy-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]hexanamide
Smiles: CCCCCC(=O)Nc1cc(O)nc2n1nc(n2)c1cccnc1

STK572495
Synonyms: ethyl4-(2-chlorophenyl)-5-hydroxy-2,7,7-trimethyl-4,6,7,8-tetrahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(C)N=C2C(=C(O)CC(C2)(C)C)C1c1ccccc1Cl

STK572497
Synonyms: 3,4,5-triethoxy-N-[(2Z)-5-[(4-ethylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)/N=c\1/[nH]nc(s1)COc1ccc(cc1)CC

STK572499
Synonyms: 7-(3-methylphenyl)-3-(pyridin-3-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Cc1cccc(c1)n1ncc2c1ncn1c2nnc1c1cccnc1

STK572500
Synonyms: 10-methyl-3-(3-methylbutyl)-2-(4-nitrophenyl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CC(CCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccc(cc1)[N+](=O)[O-])C

STK572501
Synonyms: 5-nitro-6-[(E)-2-(thiophen-3-yl)ethenyl]pyrimidine-2,4-diol
Smiles: Oc1nc(/C=C/c2ccsc2)c(c(n1)O)[N+](=O)[O-]

STK572502
Synonyms: 8-bromo-N-(2-methylphenyl)[1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: Brc1ccc2c(c1)c1ncnc(c1o2)Nc1ccccc1C

STK572503
Synonyms: 2,2-dimethyl-8-(piperidin-1-yl)-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCCCC1

STK572505
Synonyms: 4-hydroxy-1-methyl-8-(4-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purin-2(6H)-one
Smiles: Cc1ccc(cc1)N1CCn2c1nc1c2c(O)nc(=O)n1C

STK572506
Synonyms: (5E)-5-[4-(azepan-1-yl)benzylidene]-1-(4-ethoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(cc2)N2CCCCCC2)/C1=O)S

STK572508
Synonyms: 2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1cc(C)ccc1OC

STK572509
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nnc1c1cccc(c1)Cl

STK572511
Synonyms: 7-(2-fluorobenzyl)-1,3-dimethyl-8-(pyrrolidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccccc1Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCC1

STK572512
Synonyms: methylN-[(5-chloro-2-methylphenyl)carbamoyl]-D-methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1cc(Cl)ccc1C

STK572513
Synonyms: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-1-(4-chlorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C1=O)S

STK572514
Synonyms: 5-(4-methoxyphenyl)-1,3,7,7-tetramethyl-10-(1-methyl-1H-indol-3-yl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: COc1ccc(cc1)c1c2c(=O)n(C)c(=O)n(c2c2n1C(C)(C)COC2c1cn(c2c1cccc2)C)C

STK572516
Synonyms: (E)-1-(2-chlorophenyl)-N-{[11-(2-methoxyphenyl)-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}methanimine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CO/N=C/c1ccccc1Cl)c1ccccc1

STK572517
Synonyms: (2'S,3S,3'S,10b'R)-3'-(phenylcarbonyl)-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)c2ccccc2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK572519
Synonyms: methylN-[(3-methoxybenzyl)carbamoyl]-D-phenylalaninate
Smiles: COC(=O)[C@@H](Cc1ccccc1)NC(=O)NCc1cccc(c1)OC

STK572520
Synonyms: 2-[(1R,4aS,8aS)-1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-N-(2,5-dimethylphenyl)acetamide
Smiles: COc1ccc(cc1[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)CC(=O)Nc1cc(C)ccc1C)OC

STK572521
Synonyms: 2-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1cccc(c1)F

STK572522
Synonyms: 1,3-dimethyl-7-(3-methylbutyl)-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C)C

STK572524
Synonyms: 4-{[(E)-(2,3-dichlorophenyl)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/c1cccc(c1Cl)Cl

STK572525
Synonyms: 1-(3-chlorophenyl)-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)c1cccc(c1)Cl)[N+](=O)[O-]

STK572528
Synonyms: (1S,2S)-N'-{(E)-[1-(2,4-dichlorobenzyl)-1H-indol-3-yl]methylidene}-2-phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cn(c2c1cccc2)Cc1ccc(cc1Cl)Cl

STK572529
Synonyms: N-(2,4-difluorophenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1ccc(cc1F)F

STK572530
Synonyms: (2Z)-2-(2,6-dichlorobenzylidene)-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C/c2c(Cl)cccc2Cl)/Oc2c1ccc(c2C[NH+]1CCCC1)[O-]

STK572531
Synonyms: N-(4-chloro-2-methylphenyl)-2-({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)Cl)nnc1COc1ccc(cc1)Cl

STK572532
Synonyms: methylN-[(3,4-dichlorophenyl)carbamoyl]-D-methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1ccc(c(c1)Cl)Cl

STK572533
Synonyms: N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylpropyl)furan-2-carboxamide
Smiles: CC(CN(C(=O)c1ccco1)Cc1cc2cc(C)ccc2[nH]c1=O)C

STK572534
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-methoxyphenyl)carbonyl]-2'-(pyridin-4-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccncc1)C(=O)Nc1c2cccc1)cccc3

STK572535
Synonyms: methylN-[(3,5-dichlorophenyl)carbamoyl]-D-leucinate
Smiles: COC(=O)[C@H](NC(=O)Nc1cc(Cl)cc(c1)Cl)CC(C)C

STK572536
Synonyms: [3-amino-5-hydroxy-4-(4-methoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydrothieno[2,3-b]quinolin-2-yl](phenyl)methanone
Smiles: COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(N)c(s2)C(=O)c1ccccc1)(C)C

STK572538
Synonyms: 4-{[(E)-(2,6-dichlorophenyl)methylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c(Cl)cccc1Cl

STK572539
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-3-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: Cc1ccc2n(c1)c(=O)c(c(n2)N1CCN(CC1)c1ccccc1F)/C=C/1\SC(=S)N(C1=O)C

STK572541
Synonyms: [4-({(2'S,3S,3'S,10b'R)-3'-[(2-methoxyphenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2'-yl}carbonyl)phenoxy]acetonitrile
Smiles: N#CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK572542
Synonyms: 4-hydroxy-1,6,7-trimethyl-8-(4-methylphenyl)-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Cc1ccc(cc1)n1c(C)c(n2c1nc1c2c(O)nc(=O)n1C)C

STK572546
Synonyms: 9-(4-methoxyphenyl)-7-phenylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine-2,4-diol
Smiles: COc1ccc(cc1)c1cc(nc2c1c1nc(O)nc(c1s2)O)c1ccccc1

STK572547
Synonyms: (1'S,3R,3'S,7a'R)-5''-chloro-7''-methyl-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(Cl)cc1C

STK572548
Synonyms: (3a'S,6a'R)-5'-[2-(3,4-dimethoxyphenyl)ethyl]-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)Nc3c2cccc3)ccc1OC

STK572549
Synonyms: 4-[({[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK572550
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-chlorophenyl)carbonyl]-2'-[(4-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK572554
Synonyms: 8-(3-chlorophenyl)-1-methyl-3-(2-methylprop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cccc(c1)Cl

STK572555
Synonyms: 2-[(E)-{2-[7-(4-fluorobenzyl)-6-hydroxy-3-methyl-2-oxo-3,7-dihydro-2H-purin-9-ium-8-yl]hydrazinylidene}methyl]-6-methoxyphenolate
Smiles: COc1cccc(c1[O-])/C=N/Nc1[nH+]c2c(n1Cc1ccc(cc1)F)c(O)nc(=O)n2C

STK572557
Synonyms: 5-[3-(benzyloxy)phenyl]-N'-[(1Z)-1-(4-bromophenyl)ethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: Brc1ccc(cc1)/C(=N\NC(=O)c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1)/C

STK572559
Synonyms: (4Z)-4-[(3-chloro-4-methylphenyl)imino]-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Nc1nc(CN2CCN(CC2)c2ccccc2F)[nH]/c(=N/c2ccc(c(c2)Cl)C)/n1

STK572561
Synonyms: methyl5-cyano-4-(2-fluorophenyl)-2-hydroxy-6-({2-[(3-methylphenyl)amino]-2-oxoethyl}sulfanyl)-3,4-dihydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=NC(=C(C1c1ccccc1F)C#N)SCC(=O)Nc1cccc(c1)C)O

STK572562
Synonyms: 9-cyclopentyl-4-ethyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: CCc1cc(=O)oc2c1ccc1c2CN(CO1)C1CCCC1

STK572563
Synonyms: 6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl2-[(tert-butoxycarbonyl)amino]butanoate
Smiles: CCC(C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl)NC(=O)OC(C)(C)C

STK572564
Synonyms: 2-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-N-[2-(4-oxo-2-thioxo-1,3-thiazolidin-3-yl)ethyl]acetamide
Smiles: COc1cc2c(cc1OC)CCN(C2C)CC(=O)NCCN1C(=S)SCC1=O

STK572565
Synonyms: (2E)-N-[(2E)-5-[(4-chlorobenzyl)sulfonyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(furan-2-yl)prop-2-enamide
Smiles: Clc1ccc(cc1)CS(=O)(=O)c1n[nH]/c(=N\C(=O)/C=C/c2ccco2)/s1

STK572567
Synonyms: 2-[(6-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-4-ylmethyl)propanamide
Smiles: CC(C(=O)NCc1ccncc1)Oc1cc2oc(=O)cc(c2cc1Cl)C

STK572568
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(3-methoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK572570
Synonyms: (4E)-5-(2,4-dimethoxyphenyl)-4-[hydroxy(4-methylphenyl)methylidene]-1-phenylpyrrolidine-2,3-dione
Smiles: COc1ccc(c(c1)OC)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1ccccc1

STK572573
Synonyms: N-(3-methylphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1c1ccccc1)c1cnccn1

STK572574
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-(1,3-thiazol-2-yl)acetamide
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCC(=O)Nc3nccs3)nnc2c2c1CC(C)(C)OC2

STK572575
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)OC)nnc1COc1ccc(cc1)Cl

STK572576
Synonyms: 1',3'-dimethyl-1,2,3,4,5,5a-hexahydro-2'H,7H,8H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2-a]azepine-6,5'-pyrimidine]-2',4',6',8(1'H,3'H)-tetrone
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2

STK572577
Synonyms: N-(4-ethylphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccccn1

STK572579
Synonyms: ethyl4-[({[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK572580
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(4-hydroxy-3-methoxyphenyl)-1-phenylpyrrolidine-2,3-dione
Smiles: COc1cc(ccc1O)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1ccccc1

STK572581
Synonyms: N-(4-methoxyphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)c1cnccn1

STK572583
Synonyms: 2-[(3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-2-ylmethyl)acetamide
Smiles: O=C(COc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1)NCc1ccccn1

STK572585
Synonyms: 8-(4-bromophenyl)-1-methyl-3-(3-methylbutyl)-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)c1ccc(cc1)Br)C

STK572586
Synonyms: 5-(4-methoxyphenyl)-4-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1c1ccc(cc1)c1nc2c(s1)cc(cc2)C

STK572587
Synonyms: 5-phenyl-4-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]thieno[2,3-d]pyrimidine
Smiles: c1ccc(cc1)c1csc2c1c(N/N=C/c1cccnc1)ncn2

STK572591
Synonyms: (4E)-1-hexyl-4-[hydroxy(4-methylphenyl)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1)OC

STK572594
Synonyms: N-[3-(2-methoxyphenyl)-1',3'-dimethyl-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl]propanamide
Smiles: CCC(=O)Nc1ccc2c(c1)CC1(C3N2CCN(C3)c2ccccc2OC)C(=O)N(C)C(=O)N(C1=O)C

STK572596
Synonyms: 1-(4-ethoxy-3-methoxyphenyl)-2-(6-fluoro-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1OC)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK572597
Synonyms: 1-(4-fluorophenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)F)nnc1c1ccccn1

STK572598
Synonyms: (1Z)-3-(2,4-dichlorophenoxy)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)butan-2-one
Smiles: COc1cc2/C(=C/C(=O)C(Oc3ccc(cc3Cl)Cl)C)/NCCc2cc1OC

STK572602
Synonyms: 5-(4-fluorophenyl)-4-{[(E)-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccc1

STK572603
Synonyms: 1,1'-{[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-yl]imino}dipropan-2-ol
Smiles: CC(CN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C)CC(O)C)O

STK572604
Synonyms: (2Z)-1-[4-(difluoromethoxy)-3-ethoxyphenyl]-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)ethanone
Smiles: CCOc1cc(ccc1OC(F)F)C(=O)/C=C/1\NCCc2c1cc(OC)c(c2)OC

STK572605
Synonyms: 7-chloro-3'-(4-fluorophenyl)-6'-hydroxy-3-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: CN1CCN2C(C1)C1(Cc3c2cccc3Cl)C(=NC(=O)N(C1=O)c1ccc(cc1)F)O

STK572606
Synonyms: (5E)-5-(biphenyl-4-ylmethylidene)-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C/c2ccc(cc2)c2ccccc2)/C(=N1)O

STK572607
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(5-methylfuran-2-yl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(o1)C

STK572609
Synonyms: (2E)-5-[4-(propan-2-yl)benzyl]-2-{(2E)-[4-(propan-2-yl)benzylidene]hydrazinylidene}-2,5-dihydro-1,3-thiazol-4-ol
Smiles: CC(c1ccc(cc1)CC1S/C(=N/N=C/c2ccc(cc2)C(C)C)/N=C1O)C

STK572610
Synonyms: 7-(3-chlorophenyl)-3-(4-chlorophenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: Clc1ccc(cc1)C1=NOC2(C1)CC(=O)N(C2=O)c1cccc(c1)Cl

STK572612
Synonyms: 2-amino-4-{3-ethoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-hydroxy-7-methyl-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)C)C1C(=C(N)Oc2c1c(O)nc(c2)C)C#N

STK572613
Synonyms: N-(4-methoxyphenyl)-2-({5-[(4-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK572614
Synonyms: N-{(1Z)-1-[1-cyano-2-(cyclohexylamino)-2-oxoethylidene]-1H-isoindol-3-yl}benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1)/C(=O)NC1CCCCC1

STK572615
Synonyms: 2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)F)nnc1c1cccc(c1)Cl

STK572618
Synonyms: (E)-[3-fluoro-4-(propan-2-yloxy)phenyl]{2-(3-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1cccc(c1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)F)OC(C)C)/[O-]

STK572620
Synonyms: 3-(4-chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidine-7-thiol
Smiles: Clc1ccc(cc1)c1c(C)nn2c1nc(C)cc2S

STK572621
Synonyms: 4-chloro-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-phenylbenzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(c1ccccc1)Cc1cc2ccccc2[nH]c1=O

STK572622
Synonyms: 2-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}ethanol
Smiles: OCCSCc1nnc(o1)c1ccccc1

STK572623
Synonyms: ethyl4-{[({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK572624
Synonyms: (4E)-5-(3,4-diethoxyphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)F

STK572626
Synonyms: 8-[(diethylammonio)methyl]-3-(naphthalen-2-yloxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: CC[NH+](Cc1c([O-])ccc2c1oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F)CC

STK572628
Synonyms: N-(2,4-dichlorophenyl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1