COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION
FULL DB
Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )
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STK961600
Synonyms: 2-({[(4'-methylbiphenyl-4-yl)oxy]acetyl}amino)benzamide
Smiles: O=C(Nc1ccccc1C(=O)N)COc1ccc(cc1)c1ccc(cc1)C
STK961611
Synonyms: propyl4-[(butoxycarbonyl)amino]benzoate
Smiles: CCCCOC(=O)Nc1ccc(cc1)C(=O)OCCC
STK961614
Synonyms: 2-(3-bromophenoxy)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Smiles: N#Cc1c(NC(=O)COc2cccc(c2)Br)sc2c1CCC(C2)C
STK961617
Synonyms: methyl3-({(2E)-2-cyano-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}amino)benzoate
Smiles: N#C/C(=C\c1ccc(cc1)C(C)C)/C(=O)Nc1cccc(c1)C(=O)OC
STK961619
Synonyms: (2E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-[4-(propan-2-yl)phenyl]prop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)C(C)C)/C(=O)Nc1nnc(s1)CC
STK961627
Synonyms: N-(4-ethylphenyl)-4-(3-methylphenoxy)butanamide
Smiles: CCc1ccc(cc1)NC(=O)CCCOc1cccc(c1)C
STK961644
Synonyms: propyl3-({[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl]carbonyl}amino)benzoate
Smiles: CCCOC(=O)c1cccc(c1)NC(=O)c1ccc(cc1)N1C(=O)c2c(C1=O)cccc2
STK961646
Synonyms: 2-({[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl]carbonyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: CC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1ccc(cc1)N1C(=O)c2c(C1=O)cccc2
STK961648
Synonyms: (2E)-3-[4-(benzyloxy)-3-methoxyphenyl]-N-(2,4-dimethoxyphenyl)prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)Nc2ccc(cc2OC)OC)ccc1OCc1ccccc1
STK961662
Synonyms: 2-bromo-N-[(2-bromo-4-methylphenyl)carbamothioyl]benzamide
Smiles: S=C(Nc1ccc(cc1Br)C)NC(=O)c1ccccc1Br
STK961663
Synonyms: N-[(2-bromo-4-methylphenyl)carbamothioyl]-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)NC(=S)Nc1ccc(cc1Br)C
STK961667
Synonyms: N-{4-[acetyl(methyl)amino]phenyl}-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Smiles: CN(c1ccc(cc1)NC(=O)CCN1C(=O)c2c(C1=O)cccc2)C(=O)C
STK961670
Synonyms: 2-{[(2E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]amino}benzamide
Smiles: N#C/C(=C\c1ccc(cc1)OC)/C(=O)Nc1ccccc1C(=O)N
STK961676
Synonyms: 5-(4-fluorophenyl)-3-phenyl-2-thioxo-2,3-dihydrothieno[2,3-d]pyrimidin-4(1H)-one
Smiles: Fc1ccc(cc1)c1csc2c1c(=O)n(c(=S)[nH]2)c1ccccc1
STK961681
Synonyms: 2-methoxyethyl4-{[(2E)-3-phenylprop-2-enoyl]amino}benzoate
Smiles: COCCOC(=O)c1ccc(cc1)NC(=O)/C=C/c1ccccc1
STK961682
Synonyms: 4-{[(2E)-3-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}prop-2-enoyl]amino}benzamide
Smiles: COc1cc(/C=C/C(=O)Nc2ccc(cc2)C(=O)N)ccc1OCc1ccc(cc1)Cl
STK961683
Synonyms: phenyl4-{[(2E)-2-cyano-3-phenylprop-2-enoyl]amino}-2-hydroxybenzoate
Smiles: N#C/C(=C\c1ccccc1)/C(=O)Nc1ccc(c(c1)O)C(=O)Oc1ccccc1
STK961684
Synonyms: 5-imino-3,4,5,6-tetrahydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Smiles: N=c1[nH]c(=O)c2c([nH]1)[nH]nn2
STK961688
Synonyms: (2E)-N-(2,4-dimethoxyphenyl)-3-[3-methoxy-4-(pentyloxy)phenyl]prop-2-enamide
Smiles: CCCCCOc1ccc(cc1OC)/C=C/C(=O)Nc1ccc(cc1OC)OC
STK961691
Synonyms: propyl(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamate
Smiles: CCCOC(=O)Nc1sc2c(c1C(=O)N)CCC2
STK961694
Synonyms: 2-(2-bromophenoxy)-1-(piperidin-1-yl)ethanone
Smiles: O=C(N1CCCCC1)COc1ccccc1Br
STK961700
Synonyms: (2E)-3-[3-methoxy-4-(pentyloxy)phenyl]prop-2-enoicacid
Smiles: CCCCCOc1ccc(cc1OC)/C=C/C(=O)O
STK961707
Synonyms: methyl5-chloro-2-methoxy-4-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}benzoate
Smiles: COC(=O)c1cc(Cl)c(cc1OC)NC(=O)c1cc(OC)c(c(c1)OC)OC
STK961708
Synonyms: (2E)-3-(3-bromo-4-methoxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide
Smiles: COc1ccc(cc1Br)/C=C/C(=O)Nc1nccs1
STK961721
Synonyms: (2E)-3-(3-methoxy-4-propoxyphenyl)-N-[4-(morpholin-4-yl)phenyl]prop-2-enamide
Smiles: CCCOc1ccc(cc1OC)/C=C/C(=O)Nc1ccc(cc1)N1CCOCC1
STK961734
Synonyms: 2-ethoxyethyl4-aminobenzoate
Smiles: CCOCCOC(=O)c1ccc(cc1)N
STK961735
Synonyms: 2,4-dibromo-6-tert-butylphenol
Smiles: Brc1cc(Br)c(c(c1)C(C)(C)C)O
STK961736
Synonyms: (2E)-3-[4-(hexyloxy)-3-methoxyphenyl]-N-(4-sulfamoylphenyl)prop-2-enamide
Smiles: CCCCCCOc1ccc(cc1OC)/C=C/C(=O)Nc1ccc(cc1)S(=O)(=O)N
STK961737
Synonyms: 2-(4-bromo-2-tert-butylphenoxy)-N-(2-methylpropyl)acetamide
Smiles: CC(CNC(=O)COc1ccc(cc1C(C)(C)C)Br)C
STK961842
Synonyms: 4-(4-tert-butylphenoxy)-1-(morpholin-4-yl)butan-1-one
Smiles: O=C(N1CCOCC1)CCCOc1ccc(cc1)C(C)(C)C
STK961844
Synonyms: N-(4-carbamoylphenyl)-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)c2c(C1=O)cccc2)Nc1ccc(cc1)C(=O)N
STK961845
Synonyms: 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[4-(piperidin-1-yl)phenyl]benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)c2c(C1=O)cccc2)Nc1ccc(cc1)N1CCCCC1
STK961898
Synonyms: 2-[(3-bromobiphenyl-4-yl)oxy]-N-(4H-1,2,4-triazol-3-yl)acetamide
Smiles: O=C(Nc1nnc[nH]1)COc1ccc(cc1Br)c1ccccc1
STK961904
Synonyms: 3-[(6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanoicacid
Smiles: Cc1cc(SCCC(=O)O)c2c(n1)ccc(c2)OC
STK962666
Synonyms: 2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)CNC1=NCCCCC1
STK962694
Synonyms: ethylsulfate
Smiles: CCOS(=O)(=O)[O-]
STK962718
Synonyms: 5-(1H-benzotriazol-1-ylmethyl)-2-(morpholin-4-ylmethyl)-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: C=CCn1c(nn(c1=S)CN1CCOCC1)Cn1nnc2c1cccc2
STK962738
Synonyms: N-(4-fluorophenyl)-3-{[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}propanamide
Smiles: C=CCn1c(SCCC(=O)Nc2ccc(cc2)F)nc2c(c1=O)c1CCCCc1s2
STK962744
Synonyms: diethyl5-[2-(2,6-dioxocyclohexylidene)hydrazinyl]-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NN=C2C(=O)CCCC2=O)sc(c1C)C(=O)OCC
STK962746
Synonyms: (5E)-3-(pyridin-3-yl)-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2cccs2)/C(=O)N1c1cccnc1
STK962750
Synonyms: (5Z)-3-benzyl-5-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-1,3-thiazolidine-2,4-dione
Smiles: O=C1S/C(=C\2/c3ccccc3N(C2=O)C)/C(=O)N1Cc1ccccc1
STK962752
Synonyms: diethyl3-methyl-5-({[(2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetyl}amino)thiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc(C)nc3c2c2CCCCc2s3)sc(c1C)C(=O)OCC
STK962753
Synonyms: diethyl3-methyl-5-{[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylsulfanyl)acetyl]amino}thiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2ncnc3c2c2CCCCc2s3)sc(c1C)C(=O)OCC
STK962755
Synonyms: 4-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine
Smiles: c1ccc(cc1)n1nnnc1Sc1ncnc2c1c1CCCc1s2
STK962763
Synonyms: N-benzyl-3-formyl-2,2-dimethyl-1,3-thiazolidine-4-carboxamide
Smiles: O=CN1C(CSC1(C)C)C(=O)NCc1ccccc1
STK962764
Synonyms: (2E)-3-(4-methoxyphenyl)-2-[(4-methylpiperidin-1-yl)carbonyl]prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(cc1)OC)/C(=O)N1CCC(CC1)C
STK962765
Synonyms: (2E)-2-cyano-3-(4-methoxyphenyl)-N-[4-(pentyloxy)phenyl]prop-2-enamide
Smiles: CCCCCOc1ccc(cc1)NC(=O)/C(=C/c1ccc(cc1)OC)/C#N
STK962788
Synonyms: ethyl7-[3-methoxy-4-(pentyloxy)phenyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: CCCCCOc1ccc(cc1OC)C1C(=C(C)Nc2n1ncn2)C(=O)OCC
STK962790
Synonyms: 6-methyl-3-[(pyridin-3-ylmethyl)amino]-1,2,4-triazin-5(4H)-one
Smiles: O=c1[nH]c(NCc2cccnc2)nnc1C
STK962812
Synonyms: 5-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}naphthalene-1-sulfinicacid
Smiles: COc1ccc(cc1)NC(=O)Cc1cccc2c1cccc2S(=O)O
STK962834
Synonyms: 2-({[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Smiles: O=C(Nc1sc2c(c1C(=O)N)CCC2)CSc1ncnc2c1cc(s2)c1ccccc1
STK962835
Synonyms: ethyl3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy]benzoate
Smiles: CCOC(=O)c1cccc(c1)Oc1ncnc2c1c(C)c(s2)C
STK962836
Synonyms: N-(3-cyanothiophen-2-yl)-2-{[4-oxo-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2sccc2C#N)nc2c(c1=O)c1CCCc1s2
STK962845
Synonyms: 1-{[4-(phenylsulfonyl)piperazin-1-yl]methyl}naphthalen-2-ol
Smiles: Oc1ccc2c(c1CN1CCN(CC1)S(=O)(=O)c1ccccc1)cccc2
STK962852
Synonyms: 4-(4-ethylpiperazin-1-yl)-2-(4-methoxyphenyl)quinazoline
Smiles: CCN1CCN(CC1)c1nc(nc2c1cccc2)c1ccc(cc1)OC
STK962865
Synonyms: 1-(5,6-dimethyl-1H-benzimidazol-1-yl)-4-(4-methylphenyl)phthalazine
Smiles: Cc1ccc(cc1)c1nnc(c2c1cccc2)n1cnc2c1cc(C)c(c2)C
STK962940
Synonyms: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5,6-dihydro-4H-1,3-thiazin-2-yl(2-methylphenyl)amino]ethanone
Smiles: O=C(c1ccc2c(c1)OCCO2)CN(c1ccccc1C)C1=NCCCS1
STK962941
Synonyms: 5-(4-nitrophenyl)-6-oxo-2-sulfanyl-1,6-dihydropyrimidine-4-carbonitrile
Smiles: N#Cc1nc(S)[nH]c(=O)c1c1ccc(cc1)[N+](=O)[O-]
STK962942
Synonyms: 3-methyl-6-(4-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: Cc1ccc(cc1)C1CSc2n(N1)c(C)nn2
STK962949
Synonyms: 2-{[6-(4-chlorophenyl)-7-oxo-7,8-dihydro[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc2n1nc(c1ccc(cc1)Cl)c(=O)[nH]2
STK962950
Synonyms: 3-methyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: Cc1nnc2n1N=C(CS2)c1ccc2c(c1)CCCC2
STK962952
Synonyms: 6-(4-methylbenzyl)-3-[(3-methylbenzyl)sulfanyl][1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
Smiles: Cc1ccc(cc1)Cc1nn2c(SCc3cccc(c3)C)nnc2[nH]c1=O
STK962953
Synonyms: 3-(methylsulfanyl)-6-[4-(propan-2-yl)benzyl]-1,2,4-triazin-5(4H)-one
Smiles: CSc1nnc(c(=O)[nH]1)Cc1ccc(cc1)C(C)C
STK963327
Synonyms: 2-{[5-(1H-benzotriazol-1-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
Smiles: O=C(c1ccccc1)CSc1nnc(n1c1ccccc1)Cn1nnc2c1cccc2
STK963696
Synonyms: 2-(3,4-dimethoxyphenyl)-7,8,9,10-tetrahydropyrimido[1,2-a]azepin-4(6H)-one
Smiles: COc1ccc(cc1OC)c1nc2CCCCCn2c(=O)c1
STK963699
Synonyms: N-[3-(trifluoromethyl)phenyl]-1,2,3-thiadiazole-4-carboxamide
Smiles: O=C(c1csnn1)Nc1cccc(c1)C(F)(F)F
STK963702
Synonyms: N~2~,N~2~,N~4~,N~4~-tetramethyl-N~6~-(4-methylphenyl)-1,3,5-triazine-2,4,6-triamine
Smiles: Cc1ccc(cc1)Nc1nc(nc(n1)N(C)C)N(C)C
STK963704
Synonyms: 5-[(1,1-dioxidotetrahydrothiophen-3-yl)amino]-2-(thiophen-2-yl)-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NC1CCS(=O)(=O)C1)c1cccs1
STK963705
Synonyms: 5-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-propyl-1,3-oxazole-4-carbonitrile
Smiles: CCCc1nc(c(o1)N1CCC(CC1)c1nc2c(s1)cccc2)C#N
STK963706
Synonyms: propan-2-yl{(5Z)-5-[2-(benzyloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetate
Smiles: CC(OC(=O)CN1C(=S)S/C(=C\c2ccccc2OCc2ccccc2)/C1=O)C
STK963707
Synonyms: 2-{(5Z)-5-[2-(benzyloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoicacid
Smiles: OC(=O)C(N1C(=S)S/C(=C\c2ccccc2OCc2ccccc2)/C1=O)C
STK963708
Synonyms: 3-[(5Z)-5-{5-bromo-2-[(4-methylbenzyl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoicacid
Smiles: OC(=O)CCN1C(=S)S/C(=C\c2cc(Br)ccc2OCc2ccc(cc2)C)/C1=O
STK963709
Synonyms: 2-(biphenyl-4-yloxy)-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide
Smiles: O=C(C(Oc1ccc(cc1)c1ccccc1)C)Nc1nnc(s1)C
STK963710
Synonyms: N-(3-phenyl-1,2,4-thiadiazol-5-yl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Smiles: O=C(C1COc2c(O1)cccc2)Nc1snc(n1)c1ccccc1
STK963711
Synonyms: 5-(3,4-dimethylphenyl)-1,2-oxazole-3-carboxylicacid
Smiles: OC(=O)c1noc(c1)c1ccc(c(c1)C)C
STK963712
Synonyms: 2-(4-fluorophenoxy)-N-[3-(thiophen-2-yl)-1,2,4-thiadiazol-5-yl]propanamide
Smiles: O=C(C(Oc1ccc(cc1)F)C)Nc1snc(n1)c1cccs1
STK963717
Synonyms: 5-{[2-(4-methoxyphenyl)ethyl]amino}-2-methyl-1,3-oxazole-4-carbonitrile
Smiles: COc1ccc(cc1)CCNc1oc(nc1C#N)C
STK963718
Synonyms: N-(4-methyl-1,2,5-oxadiazol-3-yl)pentanamide
Smiles: CCCCC(=O)Nc1nonc1C
STK963719
Synonyms: 2-(4-bromophenoxy)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide
Smiles: O=C(Nc1snc(n1)C)COc1ccc(cc1)Br
STK963720
Synonyms: 2-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide
Smiles: Cc1nsc(n1)NC(=O)c1ccccc1C
STK963722
Synonyms: 5-bromo-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]furan-2-carboxamide
Smiles: COc1cc(ccc1OC)c1nsc(n1)NC(=O)c1ccc(o1)Br
STK963723
Synonyms: 3-chloro-4-methoxy-N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}benzamide
Smiles: COc1ccc(cc1Cl)C(=O)NCC1(CCCCC1)N1CCN(CC1)C
STK963725
Synonyms: N~6~-(4-ethoxyphenyl)-N~2~,N~2~,N~4~,N~4~-tetramethyl-1,3,5-triazine-2,4,6-triamine
Smiles: CCOc1ccc(cc1)Nc1nc(nc(n1)N(C)C)N(C)C
STK963726
Synonyms: 2-tert-butyl-5-{[2-(furan-2-yl)-2-(morpholin-4-yl)ethyl]amino}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NCC(c1ccco1)N1CCOCC1)C(C)(C)C
STK963731
Synonyms: N-[3-(4-methylphenyl)-1,2,4-thiadiazol-5-yl]butanamide
Smiles: CCCC(=O)Nc1snc(n1)c1ccc(cc1)C
STK963732
Synonyms: 5-{[2-(dimethylamino)-2-phenylethyl]amino}-2-(2-methylpropyl)-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NCC(c1ccccc1)N(C)C)CC(C)C
STK963733
Synonyms: N-[3-(methylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
Smiles: CNC(=O)c1c(NC(=O)c2noc(c2)c2cccs2)sc2c1CCCC2
STK963735
Synonyms: 3-methyl-N-[2-(trifluoromethyl)phenyl]-1-benzofuran-2-carboxamide
Smiles: O=C(c1oc2c(c1C)cccc2)Nc1ccccc1C(F)(F)F
STK963737
Synonyms: methyl3-{(5Z)-5-[2-(benzyloxy)-5-bromobenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoate
Smiles: COC(=O)CCN1C(=S)S/C(=C\c2cc(Br)ccc2OCc2ccccc2)/C1=O
STK963738
Synonyms: ethyl3-[(5E)-5-{2-[(4-methylbenzyl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Smiles: CCOC(=O)CCN1C(=S)S/C(=C/c2ccccc2OCc2ccc(cc2)C)/C1=O
STK963739
Synonyms: 4-{(5Z)-5-[2-(benzyloxy)-5-bromobenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoicacid
Smiles: OC(=O)CCCN1C(=S)S/C(=C\c2cc(Br)ccc2OCc2ccccc2)/C1=O
STK963740
Synonyms: 4-[(5E)-5-{5-bromo-2-[(4-tert-butylbenzyl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoicacid
Smiles: OC(=O)CCCN1C(=S)S/C(=C/c2cc(Br)ccc2OCc2ccc(cc2)C(C)(C)C)/C1=O
STK963751
Synonyms: 2-(4-ethoxyphenyl)-3-phenyl-4,5-dihydroimidazo[1,2-a]quinolin-3-ium
Smiles: CCOc1ccc(cc1)c1cn2c([n+]1c1ccccc1)CCc1c2cccc1
STK963820
Synonyms: 6-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-N,N'-diethyl-1,3,5-triazine-2,4-diamine
Smiles: CCNc1nc(N/N=C/c2ccc(cc2)Br)nc(n1)NCC
STK963844
Synonyms: 4-[(Z)-2-(4-chlorophenyl)-2-cyanoethenyl]-2-methoxyphenyl2-methylpropanoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)C(C)C)/c1ccc(cc1)Cl
STK963868
Synonyms: 4-(2,3-dimethylphenyl)-5-methyl-2-(piperidin-1-ylmethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1nn(c(=S)n1c1cccc(c1C)C)CN1CCCCC1
STK963870
Synonyms: [(2Z)-2-[(2,6-dichlorophenyl)imino]-4-phenyl-1,3-thiazol-3(2H)-yl](phenyl)methanone
Smiles: Clc1cccc(c1/N=c/1\scc(n1C(=O)c1ccccc1)c1ccccc1)Cl
STK963871
Synonyms: 1-(4-bromophenyl)-3-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium
Smiles: COc1ccc(cc1)c1c[n+](c2n1CCCCC2)c1ccc(cc1)Br
STK963872
Synonyms: (5E)-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5-(4-methoxybenzylidene)-3-(prop-2-en-1-yl)-3,5-dihydro-4H-imidazol-4-one
Smiles: C=CCN1C(=N/C(=C/c2ccc(cc2)OC)/C1=O)SCC(=O)c1ccc(cc1)Cl
STK963873
Synonyms: 1-(4-bromophenyl)-3-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-1-ium
Smiles: Brc1ccc(cc1)[n+]1cc(n2c1CCCC2)c1ccccc1
STK963874
Synonyms: 3-(4-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium
Smiles: Fc1ccc(cc1)c1c[n+](c2n1CCCCC2)c1cccc(c1)C(F)(F)F
STK963877
Synonyms: 6-(3-nitrophenyl)-3-(trifluoromethyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: [O-][N+](=O)c1cccc(c1)C1=Nn2c(SC1)nnc2C(F)(F)F
STK963881
Synonyms: 2-chloro-N-[5-hydroxy-1-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-1H-pyrazol-3-yl]benzamide
Smiles: O=C(c1ccccc1Cl)Nc1nn(c(c1C1=NCCCCC1)O)c1ccccc1
STK963882
Synonyms: 4-{[(E)-(4-nitrophenyl)methylidene]amino}-5-(trifluoromethyl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1ccc(cc1)[N+](=O)[O-])C(F)(F)F
STK963883
Synonyms: 2-(2-iminopyrrolidin-1-yl)-1-phenylethanone
Smiles: N=C1CCCN1CC(=O)c1ccccc1
STK963884
Synonyms: 4-{[(E)-(2,4-dimethoxyphenyl)methylidene]amino}-5-ethyl-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(c(c1)OC)/C=N/n1c(S)nnc1CC
STK963886
Synonyms: 4-(2-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol
Smiles: Cc1ccccc1n1c(COc2ccccc2)nnc1S
STK963887
Synonyms: 2-acetyl-N-(2,3-dimethylphenyl)hydrazinecarbothioamide
Smiles: CC(=O)NNC(=S)Nc1cccc(c1C)C
STK963891
Synonyms: 2-[(2E)-2-{[4-(difluoromethoxy)phenyl]imino}-5-methyl-4-(4-methylphenyl)-1,3-thiazol-3(2H)-yl]ethanol
Smiles: OCCn1/c(=N\c2ccc(cc2)OC(F)F)/sc(c1c1ccc(cc1)C)C
STK963894
Synonyms: 2-[(2Z)-2-[(2-methylphenyl)imino]-4-phenyl-1,3-thiazol-3(2H)-yl]ethanol
Smiles: OCCn1/c(=N/c2ccccc2C)/scc1c1ccccc1
STK963895
Synonyms: 2-[(2Z)-2-[(2,3-dimethylphenyl)imino]-4-(4-methoxyphenyl)-1,3-thiazol-3(2H)-yl]ethanol
Smiles: OCCn1/c(=N/c2cccc(c2C)C)/scc1c1ccc(cc1)OC
STK963896
Synonyms: 2-[(2Z)-4-(4-fluorophenyl)-2-[(2-methylphenyl)imino]-1,3-thiazol-3(2H)-yl]ethanol
Smiles: OCCn1/c(=N/c2ccccc2C)/scc1c1ccc(cc1)F
STK963897
Synonyms: 2-[(4-amino-6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(c(=O)n1N)C
STK963898
Synonyms: 1-(2,5-dimethoxyphenyl)pyrrolidin-2-imine
Smiles: COc1ccc(c(c1)N1CCCC1=N)OC
STK963899
Synonyms: 2-[4,5-dihydro-1,3-thiazol-2-yl(3-methylphenyl)amino]-1-(4-fluorophenyl)ethanone
Smiles: Fc1ccc(cc1)C(=O)CN(c1cccc(c1)C)C1=NCCS1
STK963900
Synonyms: 2-[(2E)-4-(4-bromophenyl)-2-{[4-(difluoromethoxy)phenyl]imino}-1,3-thiazol-3(2H)-yl]ethanol
Smiles: OCCn1/c(=N\c2ccc(cc2)OC(F)F)/scc1c1ccc(cc1)Br
STK963901
Synonyms: 1-(2-methylphenyl)-3-(3-methyl-5-sulfanyl-4H-1,2,4-triazol-4-yl)thiourea
Smiles: S=C(Nn1c(C)nnc1S)Nc1ccccc1C
STK963902
Synonyms: 5-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1NN=C(C1)CSc1ccc(cc1)C
STK963903
Synonyms: 2-[(2E)-4-[4-(difluoromethoxy)phenyl]-2-[(4-methoxyphenyl)imino]-1,3-thiazol-3(2H)-yl]ethanol
Smiles: OCCn1/c(=N\c2ccc(cc2)OC)/scc1c1ccc(cc1)OC(F)F
STK963907
Synonyms: (2E)-3-(3-bromo-4-methoxyphenyl)-N-[4-(dimethylamino)phenyl]prop-2-enamide
Smiles: COc1ccc(cc1Br)/C=C/C(=O)Nc1ccc(cc1)N(C)C
STK963912
Synonyms: 3-formyl-2,2-dimethyl-N-(1,3,4-thiadiazol-2-yl)-1,3-thiazolidine-4-carboxamide
Smiles: O=CN1C(CSC1(C)C)C(=O)Nc1scnn1
STK963916
Synonyms: N-(furan-2-ylmethyl)-1H-benzimidazole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)nc[nH]2)NCc1ccco1
STK963934
Synonyms: 2-(4-methylphenyl)-5-[(4-methylphenyl)sulfanyl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1Sc1ccc(cc1)C)c1ccc(cc1)C
STK964018
Synonyms: ethyl2-{[4-(4-tert-butylphenoxy)butanoyl]amino}-5-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1cc(sc1NC(=O)CCCOc1ccc(cc1)C(C)(C)C)c1ccccc1
STK964020
Synonyms: 4-(3-methylphenoxy)-N-(4-sulfamoylphenyl)butanamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CCCOc1cccc(c1)C
STK964024
Synonyms: N-{(5E)-4-oxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-2-thioxo-1,3-thiazolidin-3-yl}acetamide
Smiles: CC(=O)NN1C(=S)S/C(=C/C=C/c2ccccc2)/C1=O
STK964027
Synonyms: methyl5-bromo-2-{[(2-nitrophenoxy)acetyl]amino}benzoate
Smiles: COC(=O)c1cc(Br)ccc1NC(=O)COc1ccccc1[N+](=O)[O-]
STK964031
Synonyms: propyl[4-(morpholin-4-yl)phenyl]carbamate
Smiles: CCCOC(=O)Nc1ccc(cc1)N1CCOCC1
STK964032
Synonyms: methyl5-chloro-2-methoxy-4-[(thiophen-2-ylcarbonyl)amino]benzoate
Smiles: COC(=O)c1cc(Cl)c(cc1OC)NC(=O)c1cccs1
STK964037
Synonyms: 3-methyl-6-phenyl-4-{[(E)-(4-{[phenyl(propan-2-yl)amino]methoxy}phenyl)methylidene]amino}-1,2,4-triazin-5(4H)-one
Smiles: CC(N(c1ccccc1)COc1ccc(cc1)/C=N/n1c(C)nnc(c1=O)c1ccccc1)C
STK964038
Synonyms: 2-{[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Smiles: CCNc1nc(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)nc(n1)NCC
STK964175
Synonyms: N-(1,3-benzodioxol-5-yl)-4-(2-methylphenoxy)butanamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CCCOc1ccccc1C
STK964222
Synonyms: 2-chloro-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide
Smiles: Cc1ccc(cc1)c1nc(sc1C)NC(=O)c1ccc(cc1Cl)[N+](=O)[O-]
STK964223
Synonyms: ethyl2-[(4-phenoxybutanoyl)amino]-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccccc1)NC(=O)CCCOc1ccccc1
STK964225
Synonyms: 4-(2,5-dimethylphenoxy)-N-[4-(piperidin-1-yl)phenyl]butanamide
Smiles: O=C(Nc1ccc(cc1)N1CCCCC1)CCCOc1cc(C)ccc1C
STK964609
Synonyms: 2-(2-ethylphenoxy)-N-[4-(piperidin-1-yl)phenyl]acetamide
Smiles: CCc1ccccc1OCC(=O)Nc1ccc(cc1)N1CCCCC1
STK964611
Synonyms: 4-chloro-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-nitrobenzamide
Smiles: Cc1ccc(cc1)c1nc(sc1C)NC(=O)c1ccc(cc1[N+](=O)[O-])Cl
STK964622
Synonyms: 3-(4-nitrophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
Smiles: [O-][N+](=O)c1ccc(cc1)c1cnc2n1CCCC2
STK964623
Synonyms: 1-(4-bromobenzyl)-3-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium
Smiles: Brc1ccc(cc1)C[n+]1cc(n2c1CCC2)c1ccccc1
STK964624
Synonyms: 2-[4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
Smiles: FC(C(Oc1ccc(cc1)c1nc2n(c1)CCC2)(F)F)C(F)(F)F
STK964625
Synonyms: 3-nitro-2-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
Smiles: [O-][N+](=O)c1c(nc2n1CCC2)c1ccccc1
STK964626
Synonyms: 3-[5-(acetylamino)pyridin-2-yl]-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidine-2-thiolate
Smiles: CC(=O)Nc1ccc(nc1)n1c([S-])nc2c(c1=O)c1CCCCc1s2
STK964700
Synonyms: 3-(3,4-dichlorophenyl)-1-(4-nitrobenzyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium
Smiles: [O-][N+](=O)c1ccc(cc1)C[n+]1cc(n2c1CCC2)c1ccc(c(c1)Cl)Cl
STK964705
Synonyms: 1-[2,5-dimethyl-1-(tetrahydrofuran-2-ylmethyl)-1H-pyrrol-3-yl]-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]ethanone
Smiles: O=C(c1cc(n(c1C)CC1CCCO1)C)CSc1ncnc2c1c(C)c(s2)C
STK964706
Synonyms: 6-phenyl-4-[4-(propan-2-yl)phenoxy]thieno[2,3-d]pyrimidine
Smiles: CC(c1ccc(cc1)Oc1ncnc2c1cc(s2)c1ccccc1)C
STK964752
Synonyms: (5E)-5-(4-hydroxy-3-methoxybenzylidene)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenyl-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1cc(ccc1O)/C=C\1/N=C(N(C1=O)c1ccccc1)SCC(=O)c1ccccc1
STK964891
Synonyms: 6-(4-nitrophenyl)-1,2,4,5-tetrazine-3(6H)-thione
Smiles: S=C1N=NC(N=N1)c1ccc(cc1)[N+](=O)[O-]
STK964892
Synonyms: ethyl2-({[(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSCc2nnc3n2CCCCC3)sc2c1CCCC2
STK964893
Synonyms: 4-amino-6-(4-methoxyphenyl)-3-(methylsulfanyl)-1,2,4-triazin-5(4H)-one
Smiles: COc1ccc(cc1)c1nnc(n(c1=O)N)SC
STK964894
Synonyms: N-(3,4-dimethylphenyl)-2-{[4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nncn1n1cccc1
STK964895
Synonyms: N-(3,4-dichlorophenyl)-2-{[5-methyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(n1n1cccc1)C
STK964896
Synonyms: methyl4-[({[5-methyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1n1cccc1)C
STK964897
Synonyms: 2-[(4-amino-5-tert-butyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1N)C(C)(C)C
STK964898
Synonyms: 1,1'-[6-(4-methoxyphenyl)-3-(trifluoromethyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]diethanone
Smiles: COc1ccc(cc1)c1c(sc2n(n1C(=O)C)c(nn2)C(F)(F)F)C(=O)C
STK964900
Synonyms: 2-{[5-methyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1n1cccc1)C
STK964901
Synonyms: N-(2,5-dimethylphenyl)-2-{[5-methyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(n1n1cccc1)C
STK964902
Synonyms: 2-{[5-methyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenyl-N-(propan-2-yl)acetamide
Smiles: CC(N(c1ccccc1)C(=O)CSc1nnc(n1n1cccc1)C)C
STK964903
Synonyms: N-(2,4-dimethylphenyl)-3-(trifluoromethyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine
Smiles: Cc1ccc(c(c1)C)NC1=Nn2c(SC1)nnc2C(F)(F)F
STK964904
Synonyms: N-(2,5-dimethylphenyl)-3-(trifluoromethyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine
Smiles: Cc1ccc(c(c1)NC1=Nn2c(SC1)nnc2C(F)(F)F)C
STK964906
Synonyms: 1-[(4H-1,2,4-triazol-3-ylsulfanyl)methyl]-2,6,7-trioxa-4-aza-1-silabicyclo[2.2.2]octane
Smiles: C1O[Si]2(OCN1CO2)CSc1[nH]cnn1
STK964907
Synonyms: N-phenyl-2-{[5-propyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCCc1nnc(n1n1cccc1)SCC(=O)Nc1ccccc1
STK964936
Synonyms: N-(2,5-dimethylphenyl)-2-[(6,8-dimethyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)sulfanyl]acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc2n1nc(C)cc2C
STK964937
Synonyms: 2-[(6,8-dimethyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)sulfanyl]-N-(4-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc2n1nc(C)cc2C
STK964939
Synonyms: 3-{[4-(4-methylphenyl)phthalazin-1-yl]sulfanyl}-5-(trifluoromethyl)-4H-1,2,4-triazol-4-amine
Smiles: Cc1ccc(cc1)c1nnc(c2c1cccc2)Sc1nnc(n1N)C(F)(F)F
STK964940
Synonyms: 8-amino-6-tert-butyl-3-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
Smiles: Fc1ccc(cc1)C(=O)CSc1nnc2n1nc(c(=O)n2N)C(C)(C)C
STK964941
Synonyms: 3-tert-butyl-6-(4-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: Fc1ccc(cc1)C1=Nn2c(SC1)nnc2C(C)(C)C
STK964943
Synonyms: N-(2-methoxyphenyl)-3-(trifluoromethyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine
Smiles: COc1ccccc1NC1=Nn2c(SC1)nnc2C(F)(F)F
STK964945
Synonyms: 3-benzyl-6-(3,4-dichlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: Clc1cc(ccc1Cl)C1=Nn2c(SC1)nnc2Cc1ccccc1
STK964946
Synonyms: N-(4-chlorophenyl)-2-[(6,8-dimethyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc2n1nc(C)cc2C
STK964947
Synonyms: N-(3-acetylphenyl)-2-[(6,8-dimethyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)sulfanyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)CSc1nnc2n1nc(C)cc2C
STK964948
Synonyms: 2-[(6,8-dimethyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc2n1nc(C)cc2C
STK964949
Synonyms: N-(3-chlorophenyl)-2-[(6,8-dimethyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)sulfanyl]acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc2n1nc(C)cc2C
STK964950
Synonyms: 2-[(6,8-dimethyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)sulfanyl]-N-[4-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc2n1nc(C)cc2C
STK964953
Synonyms: 7-methyl-N-(4-methylphenyl)-2-[(4-methylphenyl)amino]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)C1(Nc2ccc(cc2)C)Sc2cc(C)ccc2NC1=O
STK964954
Synonyms: N-[4-(3-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl)phenyl]propanamide
Smiles: CCC(=O)Nc1ccc(cc1)C1=Nn2c(SC1)nnc2C
STK964955
Synonyms: N-[4-(3-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)C1=Nn2c(SC1)nnc2C
STK964956
Synonyms: 3-[(1,3-benzodioxol-5-ylmethyl)amino]-6-(4-methoxybenzyl)-1,2,4-triazin-5(4H)-one
Smiles: COc1ccc(cc1)Cc1nnc([nH]c1=O)NCc1ccc2c(c1)OCO2
STK964957
Synonyms: 2-{[5,7-bis(propan-2-ylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Smiles: CC(Nc1nc(NC(C)C)nc2n1c(SCC(=O)Nc1ccc3c(c1)OCCO3)nn2)C
STK964958
Synonyms: 6-(4-methylbenzyl)-3-[(2-methylbenzyl)sulfanyl][1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
Smiles: Cc1ccc(cc1)Cc1nn2c(SCc3ccccc3C)nnc2[nH]c1=O
STK964959
Synonyms: 3-{4-amino-3-[(4-methylphenyl)amino]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}propanoicacid
Smiles: OC(=O)CCc1nnc(n(c1=O)N)Nc1ccc(cc1)C
STK964962
Synonyms: 6-benzyl-3-[(2-phenylethyl)amino]-1,2,4-triazin-5(4H)-one
Smiles: O=c1[nH]c(NCCc2ccccc2)nnc1Cc1ccccc1
STK964964
Synonyms: 3-(1,3-benzodioxol-5-ylamino)-6-(4-tert-butylphenyl)-1,2,4-triazin-5(4H)-one
Smiles: O=c1[nH]c(nnc1c1ccc(cc1)C(C)(C)C)Nc1ccc2c(c1)OCO2
STK964975
Synonyms: (2E)-3-[4-(benzyloxy)-3-methoxyphenyl]-N-[5-(tetrahydrofuran-2-yl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)Nc2nnc(s2)C2CCCO2)ccc1OCc1ccccc1
STK964978
Synonyms: 5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(pentan-3-yl)-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)C(CC)CC
STK965070
Synonyms: 2-(8-chloro-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(3-methylphenyl)acetamide
Smiles: Cc1cccc(c1)NC(=O)Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C
STK965072
Synonyms: 1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-3-(4-chlorophenyl)urea
Smiles: O=C(Nc1sc(c(n1)C)C(=O)C)Nc1ccc(cc1)Cl
STK965073
Synonyms: 2-(1H-benzotriazol-1-yl)-N-(2,5-dichlorophenyl)acetamide
Smiles: O=C(Cn1nnc2c1cccc2)Nc1cc(Cl)ccc1Cl
STK965074
Synonyms: 7-[1-(4-ethoxyphenyl)-1-oxopropan-2-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCOc1ccc(cc1)C(=O)C(n1cnc2c1c(=O)[nH]c(=O)n2C)C
STK965075
Synonyms: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1csc(n1)N(c1ccc(cc1)C)C(=O)C
STK965076
Synonyms: 5-benzyl-3-(4-chlorophenyl)-7-phenyl-5H-imidazo[2,1-c][1,2,4]triazol-6(7H)-one
Smiles: Clc1ccc(cc1)c1nnc2n1C(Cc1ccccc1)C(=O)N2c1ccccc1
STK965077
Synonyms: N-(3-methoxyphenyl)-2-{[4-(2-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1c1ccccc1C)COc1ccccc1
STK965078
Synonyms: 4-methyl-N-(4-propylphenyl)-N-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)benzenesulfonamide
Smiles: CCCc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)Cc1nnc2n1CCCCC2
STK965079
Synonyms: 6-(2-chlorobenzyl)-3-{[2-(6-methoxy-1H-indol-3-yl)ethyl]amino}-1,2,4-triazin-5(4H)-one
Smiles: COc1ccc2c(c1)[nH]cc2CCNc1nnc(c(=O)[nH]1)Cc1ccccc1Cl
STK965080
Synonyms: 6-(4-chlorobenzyl)-3-{[2-(6-methoxy-1H-indol-3-yl)ethyl]amino}-1,2,4-triazin-5(4H)-one
Smiles: COc1ccc2c(c1)[nH]cc2CCNc1nnc(c(=O)[nH]1)Cc1ccc(cc1)Cl
STK965081
Synonyms: 3-{[2-(6-methoxy-1H-indol-3-yl)ethyl]amino}-6-(4-methylphenyl)-1,2,4-triazin-5(4H)-one
Smiles: COc1ccc2c(c1)[nH]cc2CCNc1nnc(c(=O)[nH]1)c1ccc(cc1)C
STK965082
Synonyms: 2-[(4-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-2H-1,4-benzothiazin-3(4H)-one
Smiles: O=C1Nc2ccccc2SC1Sc1nncn1N
STK965083
Synonyms: 3-[3-(4-fluorophenyl)-3,4-dihydro-2H-1,4-benzothiazin-2-yl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
Smiles: Fc1ccc(cc1)C1Nc2ccccc2SC1c1nnc2n1CCCCC2
STK965084
Synonyms: 4-(2-amino-1,3-thiazol-4-yl)-2-chlorophenol
Smiles: Nc1scc(n1)c1ccc(c(c1)Cl)O
STK965085
Synonyms: 3-(4-chlorophenyl)-7-[(4-methoxyphenyl)amino]-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Smiles: COc1ccc(cc1)Nc1nn2c(s1)nnc(c2=O)c1ccc(cc1)Cl
STK965086
Synonyms: 7-[(4-methoxyphenyl)amino]-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Smiles: COc1ccc(cc1)Nc1nn2c(s1)nnc(c2=O)C
STK965087
Synonyms: 3-methyl-7-[(4-methylphenyl)amino]-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Smiles: Cc1ccc(cc1)Nc1sc2n(n1)c(=O)c(nn2)C
STK965089
Synonyms: 2-[(4-chlorophenyl)carbonyl]-6-(4-hydroxyphenyl)-3-propyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-7-one
Smiles: CCCc1c(sc2n1nc(c1ccc(cc1)O)c(=O)n2)C(=O)c1ccc(cc1)Cl
STK965090
Synonyms: 2-[(4-chlorophenyl)carbonyl]-6-(4-methoxyphenyl)-3-propyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-7-one
Smiles: CCCc1c(sc2n1nc(c1ccc(cc1)OC)c(=O)n2)C(=O)c1ccc(cc1)Cl
STK965093
Synonyms: 2-[(4-chlorophenyl)carbonyl]-3-ethyl-6-(4-methoxyphenyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-7-one
Smiles: CCc1c(sc2n1nc(c1ccc(cc1)OC)c(=O)n2)C(=O)c1ccc(cc1)Cl
STK965095
Synonyms: 2-amino-N-(4-ethoxyphenyl)-3-(phenylcarbonyl)indolizine-1-carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)c1c2ccccn2c(c1N)C(=O)c1ccccc1
STK965097
Synonyms: 4-amino-3-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}-6-(4-chlorophenyl)-1,2,4-triazin-5(4H)-one
Smiles: Clc1ccc(cc1)c1nnc(n(c1=O)N)NCCc1c[nH]c2c1cc(Cl)cc2
STK965100
Synonyms: 6-(4-fluorobenzyl)-3-{[2-(6-methoxy-1H-indol-3-yl)ethyl]amino}-1,2,4-triazin-5(4H)-one
Smiles: COc1ccc2c(c1)[nH]cc2CCNc1nnc(c(=O)[nH]1)Cc1ccc(cc1)F
STK965101
Synonyms: 6-(4-chlorophenyl)-3-{[2-(6-methoxy-1H-indol-3-yl)ethyl]amino}-1,2,4-triazin-5(4H)-one
Smiles: COc1ccc2c(c1)[nH]cc2CCNc1nnc(c(=O)[nH]1)c1ccc(cc1)Cl
STK965102
Synonyms: 3-{[2-(6-methoxy-1H-indol-3-yl)ethyl]amino}-6-[4-(propan-2-yl)benzyl]-1,2,4-triazin-5(4H)-one
Smiles: COc1ccc2c(c1)[nH]cc2CCNc1nnc(c(=O)[nH]1)Cc1ccc(cc1)C(C)C
STK965104
Synonyms: 6-(4-fluorophenyl)-3-{[2-(6-methoxy-1H-indol-3-yl)ethyl]amino}-1,2,4-triazin-5(4H)-one
Smiles: COc1ccc2c(c1)[nH]cc2CCNc1nnc(c(=O)[nH]1)c1ccc(cc1)F
STK965106
Synonyms: 6-(4-fluorophenyl)-3-{[2-(5-methyl-1H-indol-3-yl)ethyl]amino}-1,2,4-triazin-5(4H)-one
Smiles: Fc1ccc(cc1)c1nnc([nH]c1=O)NCCc1c[nH]c2c1cc(C)cc2
STK965112
Synonyms: 6-benzyl-3-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}-1,2,4-triazin-5(4H)-one
Smiles: Clc1ccc2c(c1)c(CCNc1nnc(c(=O)[nH]1)Cc1ccccc1)c[nH]2
STK965114
Synonyms: 3-(2-methoxyphenyl)-1-(4-phenyl-1,3-thiazol-2-yl)-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea
Smiles: COc1ccccc1NC(=O)N(c1scc(n1)c1ccccc1)C1=NCCCCC1
STK965115
Synonyms: 1-(4-acetyl-5-methyl-1,3-thiazol-2-yl)-3-(4-chlorophenyl)-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea
Smiles: Clc1ccc(cc1)NC(=O)N(c1nc(c(s1)C)C(=O)C)C1=NCCCCC1
STK965116
Synonyms: 3-(3-chlorophenyl)-1-(3,4-dihydro-2H-pyrrol-5-yl)-1-(3-methylphenyl)urea
Smiles: Clc1cccc(c1)NC(=O)N(c1cccc(c1)C)C1=NCCC1
STK965117
Synonyms: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)ethanone
Smiles: O=C(c1ccc2c(c1)OCCO2)CNC1=NCCCCC1
STK965118
Synonyms: 2-[methyl(3,4,5,6-tetrahydropyridin-2-yl)amino]-1-phenylethanone
Smiles: CN(C1=NCCCC1)CC(=O)c1ccccc1
STK965119
Synonyms: 2-(3-methylbut-2-en-1-yl)-3-(5-phenyl-1,2-oxazol-3-yl)cyclopentanone
Smiles: CC(=CCC1C(=O)CCC1c1noc(c1)c1ccccc1)C
STK965120
Synonyms: 1-[2-(4-bromophenyl)-2-oxoethyl]azepan-2-one
Smiles: Brc1ccc(cc1)C(=O)CN1CCCCCC1=O
STK965122
Synonyms: 1-(3-nitrophenyl)-2-[phenyl(pyridin-2-yl)amino]ethanone
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CN(c1ccccn1)c1ccccc1
STK965123
Synonyms: 1-(4-methoxyphenyl)-2-[(4-methoxyphenyl)(3,4,5,6-tetrahydropyridin-2-yl)amino]ethanone
Smiles: COc1ccc(cc1)C(=O)CN(C1=NCCCC1)c1ccc(cc1)OC
STK965124
Synonyms: 2-[(4-methoxyphenyl)(3,4,5,6-tetrahydropyridin-2-yl)amino]-1-(3-nitrophenyl)ethanone
Smiles: COc1ccc(cc1)N(C1=NCCCC1)CC(=O)c1cccc(c1)[N+](=O)[O-]
STK965125
Synonyms: 2-[benzyl(5,6-dihydro-4H-1,3-thiazin-2-yl)amino]-1-(3-nitrophenyl)ethanone
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CN(C1=NCCCS1)Cc1ccccc1
STK965126
Synonyms: 2-(3,4,5-trimethoxyphenyl)-7,8,9,10-tetrahydropyrimido[1,2-a]azepin-4(6H)-one
Smiles: COc1c(OC)cc(cc1OC)c1nc2CCCCCn2c(=O)c1
STK965127
Synonyms: 1-(4-fluorophenyl)-2-[(4-methoxyphenyl)(3,4,5,6-tetrahydropyridin-2-yl)amino]ethanone
Smiles: COc1ccc(cc1)N(C1=NCCCC1)CC(=O)c1ccc(cc1)F
STK965128
Synonyms: 2-[(2-methoxyphenyl)(3,4,5,6-tetrahydropyridin-2-yl)amino]-1-(thiophen-2-yl)ethanone
Smiles: COc1ccccc1N(C1=NCCCC1)CC(=O)c1cccs1
STK965129
Synonyms: 1-(3,4-dimethoxyphenyl)-2-[(4-methylphenyl)(3,4,5,6-tetrahydropyridin-2-yl)amino]ethanone
Smiles: COc1cc(ccc1OC)C(=O)CN(c1ccc(cc1)C)C1=NCCCC1
STK965130
Synonyms: 2-[(4-methylphenyl)(3,4,5,6-tetrahydropyridin-2-yl)amino]-1-(thiophen-2-yl)ethanone
Smiles: Cc1ccc(cc1)N(C1=NCCCC1)CC(=O)c1cccs1
STK965131
Synonyms: 1-(2-fluoro-4-methoxyphenyl)-2-[phenyl(3,4,5,6-tetrahydropyridin-2-yl)amino]ethanone
Smiles: COc1ccc(c(c1)F)C(=O)CN(c1ccccc1)C1=NCCCC1
STK965132
Synonyms: 2-[(2-methoxyphenyl)(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-(thiophen-2-yl)ethanone
Smiles: COc1ccccc1N(C1=NCCCCC1)CC(=O)c1cccs1
STK965141
Synonyms: 2-(2-fluorophenoxy)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
Smiles: O=C(Nc1nc2c(s1)CCCC2)COc1ccccc1F
STK965149
Synonyms: N-[3-(4-methylphenyl)-1,2,4-thiadiazol-5-yl]benzamide
Smiles: Cc1ccc(cc1)c1nsc(n1)NC(=O)c1ccccc1
STK965150
Synonyms: 2-phenyl-5-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)CCc1ccccn1)c1ccccc1
STK965158
Synonyms: 4-[2-(propan-2-yl)phenoxy]butanoicacid
Smiles: OC(=O)CCCOc1ccccc1C(C)C
STK965159
Synonyms: 7-[3-methoxy-4-(propan-2-yloxy)phenyl]-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1cc(ccc1OC(C)C)C1C(=C(C)Nc2n1nnn2)C(=O)N
STK965165
Synonyms: N-(isoquinolin-5-yl)-4-methyl-1,2,3-thiadiazole-5-carboxamide
Smiles: O=C(c1snnc1C)Nc1cccc2c1ccnc2
STK965166
Synonyms: 2-(3,4-dimethylphenoxy)-N-{[1-(morpholin-4-yl)cyclohexyl]methyl}propanamide
Smiles: O=C(C(Oc1ccc(c(c1)C)C)C)NCC1(CCCCC1)N1CCOCC1
STK965168
Synonyms: N-(4-{[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl}phenyl)-2-phenylacetamide
Smiles: O=C(Cc1ccccc1)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)c1nc2c(s1)cccc2
STK965169
Synonyms: N-(4-{[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl}phenyl)-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)c1nc2c(s1)cccc2
STK965179
Synonyms: 4-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1snc(n1)C
STK965181
Synonyms: (3-methyl-1-benzofuran-2-yl){4-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperazin-1-yl}methanone
Smiles: Cc1nonc1CN1CCN(CC1)C(=O)c1oc2c(c1C)cccc2
STK965182
Synonyms: 5-{[2-(furan-2-yl)-2-(morpholin-4-yl)ethyl]amino}-2-(thiophen-2-yl)-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NCC(c1ccco1)N1CCOCC1)c1cccs1
STK965187
Synonyms: 2-methyl-N-[3-(4-methylphenyl)-1,2,4-thiadiazol-5-yl]propanamide
Smiles: O=C(C(C)C)Nc1snc(n1)c1ccc(cc1)C
STL333212
Synonyms: 4-[(E)-{[4-(2,4-dimethylbenzyl)piperazin-1-yl]imino}methyl]benzene-1,3-diol
Smiles: Cc1ccc(c(c1)C)CN1CCN(CC1)/N=C/c1ccc(cc1O)O
STL333946
Synonyms: 4-[(E)-{[4-(2-methoxyphenyl)piperazin-1-yl]imino}methyl]benzene-1,2-diol
Smiles: COc1ccccc1N1CCN(CC1)/N=C/c1ccc(c(c1)O)O
STL335093
Synonyms: 4-[(E)-{[4-(2-methoxyphenyl)piperazin-1-yl]imino}methyl]benzene-1,3-diol
Smiles: COc1ccccc1N1CCN(CC1)/N=C/c1ccc(cc1O)O
STL335288
Synonyms: 4-[(E)-{[4-(2-methoxyphenyl)piperazin-1-yl]imino}methyl]benzoicacid
Smiles: COc1ccccc1N1CCN(CC1)/N=C/c1ccc(cc1)C(=O)O
STL335379
Synonyms: 4-[(E)-{[4-(4-chlorobenzyl)piperazin-1-yl]imino}methyl]-2,6-dimethoxyphenol
Smiles: COc1cc(/C=N/N2CCN(CC2)Cc2ccc(cc2)Cl)cc(c1O)OC
STL334844
Synonyms: 4-[(E)-{[4-(4-chlorobenzyl)piperazin-1-yl]imino}methyl]-2,6-dimethoxyphenylacetate
Smiles: COc1cc(/C=N/N2CCN(CC2)Cc2ccc(cc2)Cl)cc(c1OC(=O)C)OC
STL333191
Synonyms: 4-[(E)-{[4-(4-chlorobenzyl)piperazin-1-yl]imino}methyl]-2-ethoxyphenol
Smiles: CCOc1cc(/C=N/N2CCN(CC2)Cc2ccc(cc2)Cl)ccc1O
STL334404
Synonyms: 4-[(E)-{[4-(4-chlorobenzyl)piperazin-1-yl]imino}methyl]-2-methoxyphenol
Smiles: COc1cc(/C=N/N2CCN(CC2)Cc2ccc(cc2)Cl)ccc1O
STL337825
Synonyms: 4-[(E)-{[4-(4-chlorobenzyl)piperazin-1-yl]imino}methyl]-2-methoxyphenylacetate
Smiles: COc1cc(/C=N/N2CCN(CC2)Cc2ccc(cc2)Cl)ccc1OC(=O)C
STL334355
Synonyms: 4-[(E)-{[4-(4-chlorobenzyl)piperazin-1-yl]imino}methyl]benzoicacid
Smiles: Clc1ccc(cc1)CN1CCN(CC1)/N=C/c1ccc(cc1)C(=O)O
STL334205
Synonyms: 4-[(E)-{[4-(4-chlorobenzyl)piperazin-1-yl]imino}methyl]phenol
Smiles: Oc1ccc(cc1)/C=N/N1CCN(CC1)Cc1ccc(cc1)Cl
STL334845
Synonyms: 4-[(E)-{[4-(4-chlorophenyl)piperazin-1-yl]imino}methyl]-2-methoxyphenol
Smiles: COc1cc(/C=N/N2CCN(CC2)c2ccc(cc2)Cl)ccc1O
STL335145
Synonyms: 4-[(E)-{[4-(4-methylbenzyl)piperazin-1-yl]imino}methyl]benzene-1,3-diol
Smiles: Cc1ccc(cc1)CN1CCN(CC1)/N=C/c1ccc(cc1O)O
STL329706
Synonyms: 4-[(E)-{[4-(6-bromo-4-phenylquinolin-2-yl)phenyl]imino}methyl]-N,N-dimethylaniline
Smiles: Brc1ccc2c(c1)c(cc(n2)c1ccc(cc1)/N=C/c1ccc(cc1)N(C)C)c1ccccc1
STL328096
Synonyms: 4-[(E)-{[4-(dimethylamino)phenyl]imino}methyl]-2-phenyl-1,3-oxazol-5-ylacetate
Smiles: CC(=O)Oc1oc(nc1/C=N/c1ccc(cc1)N(C)C)c1ccccc1
STL328121
Synonyms: 4-[(E)-{[4-(dimethylamino)phenyl]imino}methyl]-2-phenyl-1,3-oxazol-5-ylbenzoate
Smiles: O=C(c1ccccc1)Oc1oc(nc1/C=N/c1ccc(cc1)N(C)C)c1ccccc1
STL299421
Synonyms: 4-[(E)-{[4-(diphenylmethyl)piperazin-1-yl]imino}methyl]-2,6-dimethoxyphenylacetate
Smiles: COc1cc(/C=N/N2CCN(CC2)C(c2ccccc2)c2ccccc2)cc(c1OC(=O)C)OC
STL325074
Synonyms: 4-[(E)-{[4-(morpholin-4-yl)phenyl]imino}methyl]phenylthiophene-2-carboxylate
Smiles: O=C(c1cccs1)Oc1ccc(cc1)/C=N/c1ccc(cc1)N1CCOCC1
STL335882
Synonyms: 4-[(E)-{[4-(naphthalen-1-ylmethyl)piperazin-1-yl]imino}methyl]benzene-1,2-diol
Smiles: Oc1cc(/C=N/N2CCN(CC2)Cc2cccc3c2cccc3)ccc1O
STL333291
Synonyms: 4-[(E)-{[4-(naphthalen-1-ylmethyl)piperazin-1-yl]imino}methyl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)/C=N/N1CCN(CC1)Cc1cccc2c1cccc2
STL334787
Synonyms: 4-[(E)-{[4-(naphthalen-1-ylmethyl)piperazin-1-yl]imino}methyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)/C=N/N1CCN(CC1)Cc1cccc2c1cccc2
STL361970
Synonyms: 4-[(E)-{[4-(pyridin-2-yl)piperazin-1-yl]imino}methyl]phenol
Smiles: Oc1ccc(cc1)/C=N/N1CCN(CC1)c1ccccn1
STL321911
Synonyms: 4-[(ethoxymethyl)amino]-1,2,5-oxadiazole-3-carboxamide
Smiles: CCOCNc1nonc1C(=O)N
STL343884
Synonyms: 4-[(furan-2-ylmethyl)sulfanyl]-2-methyl[1]benzofuro[3,2-d]pyrimidine
Smiles: Cc1nc(SCc2ccco2)c2c(n1)c1ccccc1o2
STL344204
Synonyms: 4-[(furan-2-ylmethyl)sulfanyl][1]benzofuro[3,2-d]pyrimidine
Smiles: c1coc(c1)CSc1ncnc2c1oc1c2cccc1
STL348375
Synonyms: 4-[(naphthalen-1-ylmethyl)sulfanyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Smiles: c1ccc(cc1)n1ncc2c1ncnc2SCc1cccc2c1cccc2
STL340799
Synonyms: 4-[(naphthalen-1-ylmethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: C1CCc2c(C1)c1c(ncnc1s2)SCc1cccc2c1cccc2
STL308366
Synonyms: 4-[(tert-butylamino)methyl]phenylpropanoate
Smiles: CCC(=O)Oc1ccc(cc1)CNC(C)(C)C
STL315940
Synonyms: 4-[(tert-butylcarbamoyl)amino]benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)NC(C)(C)C
STL362901
Synonyms: 4-[(tetrahydrofuran-2-ylmethyl)(thiophen-2-ylmethyl)sulfamoyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)S(=O)(=O)N(Cc1cccs1)CC1CCCO1
STL330184
Synonyms: 4-[(Z)-(1-tert-butyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)/C=C\1/C(=O)NC(=O)N(C1=O)C(C)(C)C
STL319625
Synonyms: 4-[(Z)-(4-hydroxy-2-oxo-1,3-thiazol-5(2H)-ylidene)methyl]-N-[2-(4-hydroxyphenyl)ethyl]benzamide
Smiles: O=C(c1ccc(cc1)/C=C/1\SC(=O)N=C1O)NCCc1ccc(cc1)O
STL326659
Synonyms: 4-[(Z)-(hydroxyimino)(4-methylpiperazin-1-yl)methyl]-1,2,5-oxadiazol-3-amine
Smiles: O/N=C(/c1nonc1N)\N1CCN(CC1)C
STL308436
Synonyms: 4-[(Z)-(hydroxyimino)(morpholin-4-yl)methyl]-1,2,5-oxadiazol-3-amine
Smiles: O/N=C(/c1nonc1N)\N1CCOCC1
STL357767
Synonyms: 4-[(Z)-(hydroxyimino)(piperidin-1-yl)methyl]-1,2,5-oxadiazol-3-amine
Smiles: O/N=C(/c1nonc1N)\N1CCCCC1
STL322912
Synonyms: 4-[(Z)-2-chloro-1,2-diphenylethenyl]phenyl3-bromopropanoate
Smiles: BrCCC(=O)Oc1ccc(cc1)/C(=C(/c1ccccc1)\Cl)/c1ccccc1
STL334135
Synonyms: 4-[(Z)-2-chloro-1,2-diphenylethenyl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)/C(=C(/c1ccccc1)\Cl)/c1ccccc1
STL305283
Synonyms: 4-[(Z)-{(2Z)-2-[(2-fluorophenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]benzoicacid
Smiles: O=C1N/C(=N/c2ccccc2F)/S/C/1=C\c1ccc(cc1)C(=O)O
STL332735
Synonyms: 4-[(Z)-{2-[4-(4-methylphenyl)piperazin-1-yl]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]phenylbenzoate
Smiles: Cc1ccc(cc1)N1CCN(CC1)C1=NC(=O)/C(=C/c2ccc(cc2)OC(=O)c2ccccc2)/S1
STL332813
Synonyms: 4-[({(5E)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetyl)amino]benzoicacid
Smiles: O=C(CN1C(=O)S/C(=C/C(=C/c2ccccc2)/C)/C1=O)Nc1ccc(cc1)C(=O)O
STL347058
Synonyms: 4-[({(5Z)-2,4-dioxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-1,3-thiazolidin-3-yl}acetyl)amino]benzoicacid
Smiles: O=C(CN1C(=O)S/C(=C\C=C\c2ccccc2)/C1=O)Nc1ccc(cc1)C(=O)O
STL352865
Synonyms: 4-[({2-[(phenylcarbonyl)amino]phenyl}carbonyl)amino]benzoicacid
Smiles: O=C(c1ccccc1NC(=O)c1ccccc1)Nc1ccc(cc1)C(=O)O
STL342025
Synonyms: 4-[({4-amino-5-[3-(propan-2-yloxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzonitrile
Smiles: N#Cc1ccc(cc1)CSc1nnc(n1N)c1cccc(c1)OC(C)C
STL300034
Synonyms: 4-[({5-[(E)-2-carboxyethenyl]-2,3-dimethoxyphenyl}sulfonyl)amino]-2-hydroxybenzoicacid
Smiles: COc1cc(/C=C/C(=O)O)cc(c1OC)S(=O)(=O)Nc1ccc(c(c1)O)C(=O)O
STL333936
Synonyms: 4-[({N'-cyano-N-[3-(trifluoromethyl)phenyl]carbamimidoyl}sulfanyl)methyl]benzoicacid
Smiles: N#C/N=C(/Nc1cccc(c1)C(F)(F)F)\SCc1ccc(cc1)C(=O)O
STL347993
Synonyms: 4-[({[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1ncnc2c1cnn2c1ccc(cc1)C
STL351791
Synonyms: 4-[({[2-(2,6-dichlorophenyl)-1,3-thiazol-4-yl]acetyl}amino)methyl]benzoicacid
Smiles: O=C(Cc1csc(n1)c1c(Cl)cccc1Cl)NCc1ccc(cc1)C(=O)O
STL351502
Synonyms: 4-[({[2-(4-chlorophenyl)-1,3-thiazol-4-yl]acetyl}amino)methyl]benzoicacid
Smiles: O=C(Cc1csc(n1)c1ccc(cc1)Cl)NCc1ccc(cc1)C(=O)O
STL351691
Synonyms: 4-[({[3-(2-ethoxyphenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetyl)amino]butanoicacid
Smiles: CCOc1ccccc1Oc1coc2c(c1=O)ccc(c2)OCC(=O)NCCCC(=O)O
STL308063
Synonyms: 4-[({[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl
STL299411
Synonyms: 4-[({[3-(4-chlorophenyl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCC3
STL340889
Synonyms: 4-[({[3-(furan-2-ylmethyl)-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nc2sc(c(c2c(=O)n1Cc1ccco1)C)C
STL347331
Synonyms: 4-[({[4,5-bis(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C
STL298934
Synonyms: 4-[({[4-(4-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C
STL298794
Synonyms: 4-[({[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1
STL299086
Synonyms: 4-[({[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccc(cc1)OC
STL298824
Synonyms: 4-[({[4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccccc1
STL302586
Synonyms: 4-[({[4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccccc1
STL341626
Synonyms: 4-[({[4-(furan-2-ylmethyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1Cc1ccco1)c1ccccn1
STL339139
Synonyms: 4-[({[4-(furan-2-ylmethyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1Cc1ccco1)c1cccnc1
STL341617
Synonyms: 4-[({[4-(furan-2-ylmethyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1Cc1ccco1)c1ccncc1
STL348261
Synonyms: 4-[({[4-(furan-2-ylmethyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1Cc1ccco1)c1ccccc1
STL339581
Synonyms: 4-[({[4-(prop-2-en-1-yl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccccn1
STL294095
Synonyms: 4-[({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1cccnc1
STL339428
Synonyms: 4-[({[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccncc1
STL340687
Synonyms: 4-[({[4-amino-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1N)c1ccc(cc1Cl)Cl
STL340846
Synonyms: 4-[({[4-amino-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1N)c1ccccc1Cl
STL338844
Synonyms: 4-[({[4-amino-5-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1N)c1ccccc1F
STL339137
Synonyms: 4-[({[4-amino-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: COc1ccccc1c1nnc(n1N)SCC(=O)Nc1ccc(cc1)C(=O)N
STL341003
Synonyms: 4-[({[4-amino-5-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1N)c1ccccc1C
STL341735
Synonyms: 4-[({[4-amino-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: COc1cc(cc(c1OC)OC)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)C(=O)N
STL338815
Synonyms: 4-[({[4-amino-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: COc1ccc(cc1OC)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)C(=O)N
STL339394
Synonyms: 4-[({[4-amino-5-(3-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCOc1cccc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)C(=O)N
STL341989
Synonyms: 4-[({[4-amino-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: COc1cccc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)C(=O)N
STL341753
Synonyms: 4-[({[4-amino-5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1N)c1ccc(cc1)Cl
STL341091
Synonyms: 4-[({[4-amino-5-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCOc1ccc(cc1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)C(=O)N
STL339617
Synonyms: 4-[({[4-amino-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: COc1ccc(cc1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)C(=O)N
STL339334
Synonyms: 4-[({[4-amino-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1N)c1ccc(cc1)C
STL341256
Synonyms: 4-[({[4-amino-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1N)c1ccc(cc1)C(C)(C)C
STL339863
Synonyms: 4-[({[4-amino-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1N)c1ccco1
STL339523
Synonyms: 4-[({[4-amino-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1N)c1ccccn1
STL339858
Synonyms: 4-[({[4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1N)c1cccnc1
STL340413
Synonyms: 4-[({[4-amino-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1N)c1ccncc1
STL294087
Synonyms: 4-[({[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccc(cc1)C
STL294090
Synonyms: 4-[({[4-ethyl-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccco1
STL340043
Synonyms: 4-[({[4-ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1nccnc1
STL340624
Synonyms: 4-[({[4-ethyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccccn1
STL294094
Synonyms: 4-[({[4-ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1cccnc1
STL294092
Synonyms: 4-[({[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccncc1
STL342013
Synonyms: 4-[({[4-methyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1C)c1ccccn1
STL294093
Synonyms: 4-[({[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1C)c1cccnc1
STL294091
Synonyms: 4-[({[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1C)c1ccncc1
STL342007
Synonyms: 4-[({[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nc2c(c1=O)c1CCCCc1s2
STL335984
Synonyms: 4-[({[5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2ccc(cc2)C(=O)O)nnc1c1ccc(cc1)OC
STL338856
Synonyms: 4-[({[5,6-dimethyl-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nc2c(c1=O)c(C)c(s2)C
STL299316
Synonyms: 4-[({[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)C)c1ccccc1Cl
STL299271
Synonyms: 4-[({[5-(2-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1Cc1ccco1)c1ccccc1Cl
STL346481
Synonyms: 4-[({[5-(2-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccccc1Cl
STL299222
Synonyms: 4-[({[5-(2-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccccc1Cl
STL299053
Synonyms: 4-[({[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccc(cc1)Cl
STL302592
Synonyms: 4-[({[5-(4-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccc(cc1)Cl
STL294088
Synonyms: 4-[({[5-(4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccc(cc1)C
STL339925
Synonyms: 4-[({[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1ncnc2c1c(cs2)c1ccc(cc1)C
STL341879
Synonyms: 4-[({[5-(furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1Cc1ccco1)c1ccco1
STL294085
Synonyms: 4-[({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccco1
STL294089
Synonyms: 4-[({[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1C)c1ccco1
STL309444
Synonyms: 4-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3,5-dimethyl-1H-pyrazol-4-yl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2[nH]ncc2C(SC1)c1c(C)nn(c1C)C1CCS(=O)(=O)C1
STL317237
Synonyms: 4-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3,5-dimethyl-1H-pyrazol-4-yl]-5-hydroxy-7-methyl-3,4-dihydro-2H-pyrano[3,2-c]pyridin-2-one
Smiles: O=C1Oc2cc(C)nc(c2C(C1)c1c(C)nn(c1C)C1CCS(=O)(=O)C1)O
STL320583
Synonyms: 4-[1-(2,4-difluorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzoicacid
Smiles: Fc1ccc(c(c1)F)n1ncc2c1N=C(O)CSC2c1ccc(cc1)C(=O)O
STL336761
Synonyms: 4-[1-(2-bromoprop-2-en-1-yl)-1H-benzimidazol-2-yl]-N,N-dimethylaniline
Smiles: BrC(=C)Cn1c(nc2c1cccc2)c1ccc(cc1)N(C)C
STL316551
Synonyms: 4-[1-(2-chlorobenzyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-4-yl]benzene-1,2-diol
Smiles: CC1=Nc2c(C(S1)c1ccc(c(c1)O)O)cnn2Cc1ccccc1Cl
STL318323
Synonyms: 4-[1-(2-chlorobenzyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-4-yl]phenol
Smiles: Oc1ccc(cc1)C1SC(=Nc2c1cnn2Cc1ccccc1Cl)C
STL320213
Synonyms: 4-[1-(2-chlorophenyl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-4-yl]phenol
Smiles: Oc1ccc(cc1)C1SC(=Nc2c1cnn2c1ccccc1Cl)C
STL313564
Synonyms: 4-[1-(2-ethoxy-2-oxoethyl)-7-hydroxy-3-methyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzoicacid
Smiles: CCOC(=O)Cn1nc(c2c1N=C(O)CSC2c1ccc(cc1)C(=O)O)C
STL319039
Synonyms: 4-[1-(2-fluorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1ccc(cc1)C(=O)O)cnn2c1ccccc1F
STL316660
Synonyms: 4-[1-(2-methoxyethyl)-1H-indol-3-yl]-1-(2-phenylmorpholin-4-yl)butan-1-one
Smiles: COCCn1cc(c2c1cccc2)CCCC(=O)N1CCOC(C1)c1ccccc1
STL316683
Synonyms: 4-[1-(2-methoxyethyl)-1H-indol-3-yl]-1-(thiomorpholin-4-yl)butan-1-one
Smiles: COCCn1cc(c2c1cccc2)CCCC(=O)N1CCSCC1
STL315300
Synonyms: 4-[1-(2-methoxyethyl)-1H-indol-3-yl]-1-[4-(methylsulfonyl)piperazin-1-yl]butan-1-one
Smiles: COCCn1cc(c2c1cccc2)CCCC(=O)N1CCN(CC1)S(=O)(=O)C
STL310722
Synonyms: 4-[1-(2-methoxyethyl)-1H-indol-3-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)butanamide
Smiles: COCCn1cc(c2c1cccc2)CCCC(=O)NC1CC(C)(C)NC(C1)(C)C
STL317625
Synonyms: 4-[1-(2-methoxyethyl)-1H-indol-3-yl]-N-(pyridin-2-ylmethyl)butanamide
Smiles: COCCn1cc(c2c1cccc2)CCCC(=O)NCc1ccccn1
STL313077
Synonyms: 4-[1-(2-methoxyethyl)-1H-indol-3-yl]-N-(pyridin-4-ylmethyl)butanamide
Smiles: COCCn1cc(c2c1cccc2)CCCC(=O)NCc1ccncc1
STL312023
Synonyms: 4-[1-(2-methoxyethyl)-1H-indol-3-yl]-N-(tetrahydro-2H-pyran-4-ylmethyl)butanamide
Smiles: COCCn1cc(c2c1cccc2)CCCC(=O)NCC1CCOCC1
STL316421
Synonyms: 4-[1-(2-methoxyethyl)-1H-indol-3-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]butanamide
Smiles: COCCn1cc(c2c1cccc2)CCCC(=O)NCc1c(C)nn(c1C)C
STL310965
Synonyms: 4-[1-(2-methoxyethyl)-1H-indol-3-yl]-N-[(1-methyl-1H-pyrrol-2-yl)methyl]butanamide
Smiles: COCCn1cc(c2c1cccc2)CCCC(=O)NCc1cccn1C
STL312381
Synonyms: 4-[1-(2-methoxyethyl)-1H-indol-3-yl]-N-[(2E)-1,3-thiazol-2(3H)-ylidene]butanamide
Smiles: COCCn1cc(c2c1cccc2)CCCC(=O)/N=c\1/scc[nH]1
STL315025
Synonyms: 4-[1-(3-bromophenyl)-5-hydroxy-6,8-dihydro-1H-imidazo[4,5-e][1,4]thiazepin-8-yl]benzoicacid
Smiles: Brc1cccc(c1)n1cnc2c1C(SCC(=N2)O)c1ccc(cc1)C(=O)O
STL316819
Synonyms: 4-[1-(3-chlorophenyl)-5-hydroxy-6,8-dihydro-1H-imidazo[4,5-e][1,4]thiazepin-8-yl]benzoicacid
Smiles: Clc1cccc(c1)n1cnc2c1C(SCC(=N2)O)c1ccc(cc1)C(=O)O
STL314456
Synonyms: 4-[1-(3-fluorophenyl)-5-hydroxy-6,8-dihydro-1H-imidazo[4,5-e][1,4]thiazepin-8-yl]benzoicacid
Smiles: Fc1cccc(c1)n1cnc2c1C(SCC(=N2)O)c1ccc(cc1)C(=O)O
STL314218
Synonyms: 4-[1-(4-chlorophenyl)-5-hydroxy-6,8-dihydro-1H-imidazo[4,5-e][1,4]thiazepin-8-yl]benzoicacid
Smiles: Clc1ccc(cc1)n1cnc2c1C(SCC(=N2)O)c1ccc(cc1)C(=O)O
STL316182
Synonyms: 4-[1-(4-chlorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzoicacid
Smiles: Clc1ccc(cc1)n1ncc2c1N=C(O)CSC2c1ccc(cc1)C(=O)O
STL356589
Synonyms: 4-[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]piperazine-1-carbaldehyde
Smiles: O=CN1CCN(CC1)C1CC(=O)N(C1=O)c1ccc(cc1)F
STL308774
Synonyms: 4-[1-(4-fluorophenyl)-5-hydroxy-6,8-dihydro-1H-imidazo[4,5-e][1,4]thiazepin-8-yl]benzoicacid
Smiles: Fc1ccc(cc1)n1cnc2c1C(SCC(=N2)O)c1ccc(cc1)C(=O)O
STL316130
Synonyms: 4-[1-(4-fluorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzoicacid
Smiles: Fc1ccc(cc1)n1ncc2c1N=C(O)CSC2c1ccc(cc1)C(=O)O
STL363212
Synonyms: 4-[1-(phenylethynyl)cyclohexyl]morpholine
Smiles: C1CCC(CC1)(C#Cc1ccccc1)N1CCOCC1
STL363211
Synonyms: 4-[1-(phenylethynyl)cyclopentyl]morpholine
Smiles: O1CCN(CC1)C1(CCCC1)C#Cc1ccccc1
STL308976
Synonyms: 4-[1-(propan-2-yl)-1H-indol-3-yl]-1-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]butan-1-one
Smiles: O=C(N1CCn2c(C1)nnc2C(F)(F)F)CCCc1cn(c2c1cccc2)C(C)C
STL308808
Synonyms: 4-[1-(propan-2-yl)-1H-indol-3-yl]-1-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}butan-1-one
Smiles: O=C(N1CCN(CC1)CCc1ccncc1)CCCc1cn(c2c1cccc2)C(C)C
STL317426
Synonyms: 4-[1-(propan-2-yl)-1H-indol-3-yl]-N-(pyridin-2-ylmethyl)butanamide
Smiles: O=C(NCc1ccccn1)CCCc1cn(c2c1cccc2)C(C)C
STL316821
Synonyms: 4-[1-(propan-2-yl)-1H-indol-3-yl]-N-(pyridin-4-ylmethyl)butanamide
Smiles: O=C(NCc1ccncc1)CCCc1cn(c2c1cccc2)C(C)C
STL314609
Synonyms: 4-[1-(propan-2-yl)-1H-indol-3-yl]-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)butanamide
Smiles: O=C(NCc1nnc2n1cccc2)CCCc1cn(c2c1cccc2)C(C)C
STL319012
Synonyms: 4-[1-(propan-2-yl)-1H-indol-3-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]butanamide
Smiles: O=C(NCc1c(C)nn(c1C)C)CCCc1cn(c2c1cccc2)C(C)C
STL311162
Synonyms: 4-[1-(propan-2-yl)-1H-indol-3-yl]-N-[(2E)-1,3-thiazol-2(3H)-ylidene]butanamide
Smiles: O=C(/N=c\1/scc[nH]1)CCCc1cn(c2c1cccc2)C(C)C
STL314468
Synonyms: 4-[1-(propan-2-yl)-1H-indol-3-yl]-N-[2-(1,3-thiazol-2-yl)ethyl]butanamide
Smiles: O=C(NCCc1nccs1)CCCc1cn(c2c1cccc2)C(C)C
STL316742
Synonyms: 4-[1-(propan-2-yl)-1H-indol-3-yl]-N-[2-(pyridin-2-yl)ethyl]butanamide
Smiles: O=C(NCCc1ccccn1)CCCc1cn(c2c1cccc2)C(C)C
STL320360
Synonyms: 4-[1-(propan-2-yl)-1H-indol-3-yl]-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]butanamide
Smiles: O=C(NCCc1nnc2n1cccc2)CCCc1cn(c2c1cccc2)C(C)C
STL315301
Synonyms: 4-[1-(propan-2-yl)-1H-indol-3-yl]-N-[3-(tetrahydrofuran-2-yl)-1H-1,2,4-triazol-5-yl]butanamide
Smiles: O=C(Nc1[nH]nc(n1)C1CCCO1)CCCc1cn(c2c1cccc2)C(C)C
STL350800
Synonyms: 4-[2,4-dioxo-3-(prop-2-en-1-yl)imidazolidin-1-yl]-N,N-dimethyl-3-(propan-2-yloxy)benzenesulfonamide
Smiles: C=CCN1C(=O)CN(C1=O)c1ccc(cc1OC(C)C)S(=O)(=O)N(C)C
STL351270
Synonyms: 4-[2,4-dioxo-3-(propan-2-yl)imidazolidin-1-yl]-3-[(2-fluorobenzyl)oxy]-N,N-dimethylbenzenesulfonamide
Smiles: CC(N1C(=O)CN(C1=O)c1ccc(cc1OCc1ccccc1F)S(=O)(=O)N(C)C)C
STL351250
Synonyms: 4-[2,4-dioxo-3-(propan-2-yl)imidazolidin-1-yl]-N,N-dimethyl-3-(2-oxo-2-phenylethoxy)benzenesulfonamide
Smiles: CC(N1C(=O)CN(C1=O)c1ccc(cc1OCC(=O)c1ccccc1)S(=O)(=O)N(C)C)C
STL307612
Synonyms: 4-[2,6-dimethyl-1-(2-methylpropyl)pyridin-4(1H)-ylidene]-2-thioxo-1,3-thiazolidin-5-one
Smiles: CC(Cn1c(C)c/c(=C/2\NC(=S)SC2=O)/cc1C)C
STL321694
Synonyms: 4-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)ethoxy]benzoicacid
Smiles: OC(=O)c1ccc(cc1)OCCn1cnc2c1c(=O)n(C)c(=O)n2C
STL329043
Synonyms: 4-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propyl]-4-methylmorpholin-4-ium
Smiles: CC(N1C(=O)c2c(C1=O)cccc2)C[N+]1(C)CCOCC1
STL297673
Synonyms: 4-[2-(1-methylpyridin-4(1H)-ylidene)ethylidene]cyclohexa-2,5-dien-1-one
Smiles: O=C1C=C/C(=C/C=c/2\ccn(cc2)C)/C=C1
STL332962
Synonyms: 4-[2-(1H-benzimidazol-2-yl)ethyl]-2,6-di-tert-butylphenol
Smiles: Oc1c(cc(cc1C(C)(C)C)CCc1nc2c([nH]1)cccc2)C(C)(C)C
STL363047
Synonyms: 4-[2-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)hydrazinyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)NN=C1C(=O)OC(OC1=O)(C)C
STL363055
Synonyms: 4-[2-(2,4-dioxopentan-3-ylidene)hydrazinyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)NN=C(C(=O)C)C(=O)C
STL350763
Synonyms: 4-[2-(2,5-dimethyl-1H-pyrrol-1-yl)ethyl]-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide
Smiles: S=C(N1CCN(CC1)CCn1c(C)ccc1C)NCCCN1CCOCC1
STL357288
Synonyms: 4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-1-oxaspiro[4.5]decan-2-one
Smiles: O=C1CC(C2(O1)CCCCC2)c1csc(n1)c1ccc(cc1)Cl
STL353224
Synonyms: 4-[2-(acridin-9-yl)hydrazinyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)NNc1c2ccccc2nc2c1cccc2
STL334954
Synonyms: 4-[2-(benzylsulfinyl)ethyl]pyridine
Smiles: O=S(Cc1ccccc1)CCc1ccncc1
STL308449
Synonyms: 4-[2-(cyclohexylsulfanyl)ethyl]pyridine
Smiles: C1CCC(CC1)SCCc1ccncc1
STL351789
Synonyms: 4-[2-(cyclopentyloxy)-3-methoxyphenyl]-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: COc1cccc(c1OC1CCCC1)C1CC(=Nc2c1c[nH]n2)O
STL325521
Synonyms: 4-[2-(decyloxy)-2-oxoethyl]-4-[2-(morpholin-4-yl)ethyl]morpholin-4-ium
Smiles: CCCCCCCCCCOC(=O)C[N+]1(CCOCC1)CCN1CCOCC1
STL323668
Synonyms: 4-[2-(difluoromethoxy)phenyl]-5-methyl-N-phenyl-1,3-thiazol-2-amine
Smiles: FC(Oc1ccccc1c1nc(sc1C)Nc1ccccc1)F
STL329174
Synonyms: 4-[2-(dimethylamino)ethyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazine-1-carboxamide
Smiles: CN(CCN1CCN(CC1)C(=O)NC12CC3CC(C2)CC(C1)C3)C
STL332445
Synonyms: 4-[2-(diphenylmethoxy)ethoxy]-N,N-diethylbut-2-yn-1-amine
Smiles: CCN(CC#CCOCCOC(c1ccccc1)c1ccccc1)CC
STL319648
Synonyms: 4-[2-(methoxymethyl)-5-methyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]phenol
Smiles: COCc1nn2c(n1)NC(CC2c1ccc(cc1)O)C
STL351048
Synonyms: 4-[2-(morpholin-4-yl)-2-oxoethyl]-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide
Smiles: S=C(N1CCN(CC1)CC(=O)N1CCOCC1)NCCCN1CCOCC1
STL317507
Synonyms: 4-[2-(propan-2-yl)-2H-tetrazol-5-yl]-N-(4-sulfamoylbenzyl)benzamide
Smiles: O=C(c1ccc(cc1)c1nnn(n1)C(C)C)NCc1ccc(cc1)S(=O)(=O)N
STL308822
Synonyms: 4-[2-(propan-2-yl)-2H-tetrazol-5-yl]-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)benzamide
Smiles: CC(n1nnc(n1)c1ccc(cc1)C(=O)NCc1nnc2n1cccc2)C
STL317647
Synonyms: 4-[2-(propan-2-yl)-2H-tetrazol-5-yl]-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide
Smiles: CC(n1nnc(n1)c1ccc(cc1)C(=O)N[C@H](c1nnc2n1cccc2)C)C
STL313052
Synonyms: 4-[2-(propan-2-yl)-2H-tetrazol-5-yl]-N-[2-(pyridin-4-yl)ethyl]benzamide
Smiles: O=C(c1ccc(cc1)c1nnn(n1)C(C)C)NCCc1ccncc1
STL316531
Synonyms: 4-[2-(propan-2-yl)-2H-tetrazol-5-yl]-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide
Smiles: CC(n1nnc(n1)c1ccc(cc1)C(=O)NCCc1nnc2n1cccc2)C
STL317971
Synonyms: 4-[2-(propan-2-yl)-2H-tetrazol-5-yl]-N-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]benzamide
Smiles: CC(c1n[nH]c(n1)NC(=O)c1ccc(cc1)c1nnn(n1)C(C)C)C
STL311334
Synonyms: 4-[2-(pyridin-2-ylmethoxy)phenyl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2[nH]ncc2C(SC1)c1ccccc1OCc1ccccn1
STL327113
Synonyms: 4-[2-amino-3,5-dicyano-6-(ethylsulfanyl)pyridin-4-yl]phenylacetate
Smiles: CCSc1nc(N)c(c(c1C#N)c1ccc(cc1)OC(=O)C)C#N
STL333097
Synonyms: 4-[2-amino-3-(cyclohexylcarbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)NC1CCCCC1
STL336578
Synonyms: 4-[2-chloro-5-(trifluoromethyl)phenyl]-5-(thiophen-2-ylmethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(cc1n1c(n[nH]c1=S)Cc1cccs1)C(F)(F)F
STL364076
Synonyms: 4-[2-oxo-2-(piperidin-1-yl)ethyl]-2H-1,4-benzoxazin-3(4H)-one
Smiles: O=C1COc2c(N1CC(=O)N1CCCCC1)cccc2
STL304966
Synonyms: 4-[2-{(Z)-2-[4-(dimethylamino)phenyl]ethenyl}-4-oxoquinazolin-3(4H)-yl]benzoicacid
Smiles: CN(c1ccc(cc1)/C=C\c1nc2ccccc2c(=O)n1c1ccc(cc1)C(=O)O)C
STL314525
Synonyms: 4-[3,5-dimethyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-1H-pyrazol-4-yl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2[nH]ncc2C(SC1)c1c(C)nn(c1C)C1(C)CCS(=O)(=O)C1
STL310643
Synonyms: 4-[3,5-dimethyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-1H-pyrazol-4-yl]-5-hydroxy-7-methyl-3,4-dihydro-2H-pyrano[3,2-c]pyridin-2-one
Smiles: O=C1Oc2cc(C)nc(c2C(C1)c1c(C)nn(c1C)C1(C)CCS(=O)(=O)C1)O
STL316581
Synonyms: 4-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazol-4-yl]-5-hydroxy-7-methyl-3,4-dihydro-2H-pyrano[3,2-c]pyridin-2-one
Smiles: O=C1Oc2cc(C)nc(c2C(C1)c1c(C)nn(c1C)C(C)C)O
STL312378
Synonyms: 4-[3,5-dimethyl-1-(pyridin-2-yl)-1H-pyrazol-4-yl]-5-hydroxy-7-methyl-3,4-dihydro-2H-pyrano[3,2-c]pyridin-2-one
Smiles: O=C1Oc2cc(C)nc(c2C(C1)c1c(C)nn(c1C)c1ccccn1)O
STL316704
Synonyms: 4-[3,7-dihydroxy-6-methyl-1-(propan-2-yl)-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-4-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)c1c2oc3c(c2nc2c1c(O)nn2C(C)C)ccc(c3C)O
STL312734
Synonyms: 4-[3-(1,3-dioxo-2-azaspiro[4.4]non-2-yl)propanoyl]-N,N-dimethylpiperazine-1-sulfonamide
Smiles: O=C(N1CCN(CC1)S(=O)(=O)N(C)C)CCN1C(=O)CC2(C1=O)CCCC2
STL348692
Synonyms: 4-[3-(2,4-dichlorophenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoicacid
Smiles: Clc1ccc(c(c1)Cl)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)C(=O)O)c1ccccc1
STL348729
Synonyms: 4-[3-(2,4-dimethoxyphenyl)-4,6-dioxo-3a,4,6,6a-tetrahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]phenylacetate
Smiles: COc1cc(OC)ccc1C1=NOC2C1C(=O)N(C2=O)c1ccc(cc1)OC(=O)C
STL318615
Synonyms: 4-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoyl]-N,N-dimethylpiperazine-1-sulfonamide
Smiles: O=C(N1CCN(CC1)S(=O)(=O)N(C)C)CCc1c(C)nc2n(c1C)nc1c2cccc1
STL349047
Synonyms: 4-[3-(2-chloro-6-fluorophenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoicacid
Smiles: O=C1N(c2ccc(cc2)C(=O)O)C(=O)C2C1ON(C2c1c(F)cccc1Cl)c1ccccc1
STL347312
Synonyms: 4-[3-(2-chlorophenyl)-4,6-dioxo-3a,4,6,6a-tetrahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)C2C(C1=O)C(=NO2)c1ccccc1Cl
STL348647
Synonyms: 4-[3-(2-fluorophenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoicacid
Smiles: O=C1N(c2ccc(cc2)C(=O)O)C(=O)C2C1ON(C2c1ccccc1F)c1ccccc1
STL348802
Synonyms: 4-[3-(2-fluorophenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccccc1F
STL316379
Synonyms: 4-[3-(2-hydroxy-5-methylphenyl)-3-phenylpropanoyl]piperazine-1-carbaldehyde
Smiles: O=CN1CCN(CC1)C(=O)CC(c1cc(C)ccc1O)c1ccccc1
STL349281
Synonyms: 4-[3-(2-methylphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoicacid
Smiles: O=C1N(c2ccc(cc2)C(=O)O)C(=O)C2C1ON(C2c1ccccc1C)c1ccccc1
STL349064
Synonyms: 4-[3-(2-methylphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccccc1C
STL299588
Synonyms: 4-[3-(3,4,5-trimethoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]benzene-1,2-diol
Smiles: COc1c(OC)cc(cc1OC)c1nnc2n1N=C(CS2)c1ccc(c(c1)O)O
STL299577
Synonyms: 4-[3-(3,4-dimethoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]benzene-1,2-diol
Smiles: COc1ccc(cc1OC)c1nnc2n1N=C(CS2)c1ccc(c(c1)O)O
STL336274
Synonyms: 4-[3-(3,5-dimethylbenzyl)-2,5-dioxopyrrolidin-1-yl]benzoicacid
Smiles: Cc1cc(cc(c1)C)CC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)O
STL348706
Synonyms: 4-[3-(3-bromo-4-methoxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(c(c1)Br)OC
STL348885
Synonyms: 4-[3-(3-ethoxy-4-propoxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoicacid
Smiles: CCCOc1ccc(cc1OCC)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)C(=O)O)c1ccccc1
STL349247
Synonyms: 4-[3-(3-ethoxy-4-propoxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile
Smiles: CCCOc1ccc(cc1OCC)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)C#N)c1ccccc1
STL337600
Synonyms: 4-[3-(3-nitrophenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoicacid
Smiles: O=C1N(c2ccc(cc2)C(=O)O)C(=O)C2C1C(c1cccc(c1)[N+](=O)[O-])N(O2)c1ccccc1
STL330655
Synonyms: 4-[3-(4-bromophenyl)-5-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1cc(OC)ccc1C1CC(=NN1C(=O)CCC(=O)O)c1ccc(cc1)Br
STL329568
Synonyms: 4-[3-(4-bromophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)C)c1ccc(cc1)Br
STL350973
Synonyms: 4-[3-(4-bromophenyl)-5-(quinoxalin-6-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc2c(c1)nccn2)c1ccc(cc1)Br
STL336020
Synonyms: 4-[3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccccc1)c1ccc(cc1)Br
STL322272
Synonyms: 4-[3-(4-bromophenyl)-7,9-dimethyl-6,8-dioxo-6,7,8,9-tetrahydro[1,2,4]triazino[3,4-f]purin-1(4H)-yl]benzoicacid
Smiles: Brc1ccc(cc1)C1=NN(c2ccc(cc2)C(=O)O)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)C
STL349310
Synonyms: 4-[3-(4-butoxy-3-ethoxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile
Smiles: CCCCOc1ccc(cc1OCC)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)C#N)c1ccccc1
STL326615
Synonyms: 4-[3-(4-chloro-2-methylphenoxy)propyl]morpholine
Smiles: Clc1ccc(c(c1)C)OCCCN1CCOCC1
STL326848
Synonyms: 4-[3-(4-chloro-3,5-dimethylphenoxy)propyl]morpholine
Smiles: Cc1cc(OCCCN2CCOCC2)cc(c1Cl)C
STL334871
Synonyms: 4-[3-(4-chlorobenzyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]benzoicacid
Smiles: Clc1ccc(cc1)Cc1n[nH]c(=S)n1c1ccc(cc1)C(=O)O
STL315944
Synonyms: 4-[3-(4-chlorophenyl)-1H-pyrazol-4-yl]-1-(propan-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: Clc1ccc(cc1)c1n[nH]cc1C1SCC(=Nc2c1cnn2C(C)C)O
STL318794
Synonyms: 4-[3-(4-chlorophenyl)-1H-pyrazol-4-yl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: Clc1ccc(cc1)c1n[nH]cc1C1SCC(=Nc2c1cn[nH]2)O
STL309733
Synonyms: 4-[3-(4-chlorophenyl)-4-(1H-pyrrol-1-yl)butanoyl]-N,N-dimethylpiperazine-1-sulfonamide
Smiles: Clc1ccc(cc1)C(CC(=O)N1CCN(CC1)S(=O)(=O)N(C)C)Cn1cccc1
STL332485
Synonyms: 4-[3-(4-chlorophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccco1)c1ccc(cc1)Cl
STL322971
Synonyms: 4-[3-(4-chlorophenyl)prop-2-yn-1-yl]-4-(prop-2-en-1-yl)morpholin-4-ium
Smiles: C=CC[N+]1(CCOCC1)CC#Cc1ccc(cc1)Cl
STL310391
Synonyms: 4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: Fc1ccc(cc1)c1n[nH]cc1C1SCC(=Nc2c1cn[nH]2)O
STL299640
Synonyms: 4-[3-(4-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]benzene-1,2-diol
Smiles: Fc1ccc(cc1)c1nnc2n1N=C(CS2)c1ccc(c(c1)O)O
STL337558
Synonyms: 4-[3-(4-hydroxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoicacid
Smiles: Oc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)C(=O)O)c1ccccc1
STL310017
Synonyms: 4-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: COc1ccc(cc1)c1n[nH]cc1C1SCC(=Nc2c1cn[nH]2)O
STL337547
Synonyms: 4-[3-(4-methylphenyl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cccs1)c1ccc(cc1)C
STL320909
Synonyms: 4-[3-(4-methylphenyl)prop-2-yn-1-yl]-4-(prop-2-en-1-yl)morpholin-4-ium
Smiles: C=CC[N+]1(CCOCC1)CC#Cc1ccc(cc1)C
STL350803
Synonyms: 4-[3-(5-bromo-1H-indol-1-yl)propanoyl]piperazine-1-carbaldehyde
Smiles: O=CN1CCN(CC1)C(=O)CCn1ccc2c1ccc(c2)Br
STL344504
Synonyms: 4-[3-(5-chloro-2-hydroxyphenyl)-3-phenylpropanoyl]piperazine-1-carbaldehyde
Smiles: O=CN1CCN(CC1)C(=O)CC(c1cc(Cl)ccc1O)c1ccccc1
STL336621
Synonyms: 4-[3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cccs1)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl
STL325915
Synonyms: 4-[3-(biphenyl-4-yl)-5-phenyl-4H-1,2,4-triazol-4-yl]-N,N-dimethylaniline
Smiles: CN(c1ccc(cc1)n1c(nnc1c1ccccc1)c1ccc(cc1)c1ccccc1)C
STL351745
Synonyms: 4-[3-(cyclopentyloxy)-4-methoxyphenyl]-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: COc1ccc(cc1OC1CCCC1)C1CC(=Nc2c1c[nH]n2)O
STL315887
Synonyms: 4-[3-(difluoromethoxy)benzyl]-6-phenylpyridazin-3-ol
Smiles: FC(Oc1cccc(c1)Cc1cc(nnc1O)c1ccccc1)F
STL315994
Synonyms: 4-[3-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridine-3,6,7-triol
Smiles: FC(Oc1cccc(c1)c1c2oc3c(c2nc2c1c(O)nn2C(C)C)ccc(c3O)O)F
STL312223
Synonyms: 4-[3-(difluoromethoxy)phenyl]-3-hydroxy-1-(propan-2-yl)-1,7-dihydro-6H-pyrazolo[3,4-b][1,3]thiazolo[5,4-e]pyridin-6-one
Smiles: FC(Oc1cccc(c1)c1c2sc(=O)[nH]c2nc2c1c(O)nn2C(C)C)F
STL318051
Synonyms: 4-[3-(difluoromethoxy)phenyl]-3-hydroxy-5-methyl-1-(propan-2-yl)-5,7-dihydroimidazo[4,5-b]pyrazolo[4,3-e]pyridin-6(1H)-one
Smiles: FC(Oc1cccc(c1)c1c2c([nH]c(=O)n2C)nc2c1c(O)nn2C(C)C)F
STL309365
Synonyms: 4-[3-(difluoromethoxy)phenyl]-5-hydroxy-7-methyl-3,4-dihydro-2H-pyrano[3,2-c]pyridin-2-one
Smiles: FC(Oc1cccc(c1)C1CC(=O)Oc2c1c(O)nc(c2)C)F
STL313147
Synonyms: 4-[3-(difluoromethoxy)phenyl]-6-methyl-1-(tetrahydro-2H-pyran-4-yl)-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3-ol
Smiles: FC(Oc1cccc(c1)C1SC(=Nc2c1c(O)nn2C1CCOCC1)C)F
STL317218
Synonyms: 4-[3-(difluoromethoxy)phenyl]-7-hydroxy-1-(propan-2-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: FC(Oc1cccc(c1)C1SCC(=Nc2c1c(=O)[nH]n2C(C)C)O)F
STL308737
Synonyms: 4-[3-(diphenylacetyl)-4,6-dioxo-3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(=NN2)C(=O)C(c1ccccc1)c1ccccc1
STL356644
Synonyms: 4-[3-(furan-2-yl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cccs1)c1ccco1
STL322190
Synonyms: 4-[3-(naphthalen-1-yl)prop-2-yn-1-yl]-4-(prop-2-en-1-yl)morpholin-4-ium
Smiles: C=CC[N+]1(CCOCC1)CC#Cc1cccc2c1cccc2
STL316984
Synonyms: 4-[3-(pyridin-2-ylmethoxy)phenyl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2[nH]ncc2C(SC1)c1cccc(c1)OCc1ccccn1
STL340354
Synonyms: 4-[3-(pyridin-3-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]benzene-1,2-diol
Smiles: Oc1cc(ccc1O)C1=Nn2c(SC1)nnc2c1cccnc1
STL308793
Synonyms: 4-[3-(pyridin-3-ylmethoxy)phenyl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2[nH]ncc2C(SC1)c1cccc(c1)OCc1cccnc1
STL335449
Synonyms: 4-[3-(thiophen-2-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)n1c(=S)[nH]nc1c1cccs1
STL328279
Synonyms: 4-[3-({N-[2-(4-methoxyphenyl)ethyl]-N'-phenylcarbamimidoyl}sulfanyl)-2,5-dioxopyrrolidin-1-yl]benzoicacid
Smiles: COc1ccc(cc1)CCN/C(=N\c1ccccc1)/SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)O
STL311917
Synonyms: 4-[3-hydroxy-5-methyl-6-oxo-1-(propan-2-yl)-1,5,6,7-tetrahydroimidazo[4,5-b]pyrazolo[4,3-e]pyridin-4-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)c1c2c([nH]c(=O)n2C)nc2c1c(O)nn2C(C)C
STL315553
Synonyms: 4-[3-hydroxy-6-methyl-1-(tetrahydro-2H-pyran-4-yl)-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-4-yl]benzoicacid
Smiles: CC1=Nc2c(C(S1)c1ccc(cc1)C(=O)O)c(nn2C1CCOCC1)O
STL317117
Synonyms: 4-[3-hydroxy-6-oxo-1-(propan-2-yl)-6,7-dihydro-1H-pyrazolo[3,4-b][1,3]thiazolo[5,4-e]pyridin-4-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)c1c2sc(=O)[nH]c2nc2c1c(O)nn2C(C)C
STL309545
Synonyms: 4-[3-methoxy-4-(2-methylpropoxy)benzyl]-6-phenylpyridazin-3-ol
Smiles: COc1cc(ccc1OCC(C)C)Cc1cc(nnc1O)c1ccccc1
STL315483
Synonyms: 4-[3-methoxy-4-(2-methylpropoxy)phenyl]-6-methyl-1-(propan-2-yl)-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridine-3,7-diol
Smiles: COc1cc(ccc1OCC(C)C)c1c2oc3c(c2nc2c1c(O)nn2C(C)C)ccc(c3C)O
STL319341
Synonyms: 4-[3-methoxy-4-(propan-2-yloxy)phenyl]-6-methyl-1-(propan-2-yl)-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridine-3,7-diol
Smiles: COc1cc(ccc1OC(C)C)c1c2oc3c(c2nc2c1c(O)nn2C(C)C)ccc(c3C)O
STL322011
Synonyms: 4-[3-methyl-2,6-dioxo-7-(1-phenylethyl)-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-ium
Smiles: O=c1[nH]c(=O)n(c2c1n(C(c1ccccc1)C)c(n2)N1CC[NH2+]CC1)C
STL336644
Synonyms: 4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1cccc(c1)N1CCN(CC1C)c1ncnc2c1cnn2c1ccccc1
STL349371
Synonyms: 4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole
Smiles: Cc1cccc(c1)N1CCN(CC1C)c1ncnc2c1[nH]c1c2cccc1
STL336636
Synonyms: 4-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1ccc(cc1)N1CCN(CC1C)c1ncnc2c1cnn2c1cccc(c1)C
STL329838
Synonyms: 4-[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]-2,6-dimethoxyphenol
Smiles: COc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)OC)c1cc(OC)c(c(c1)OC)O
STL335696
Synonyms: 4-[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]-2-ethoxyphenol
Smiles: CCOc1cc(ccc1O)c1nc(c([nH]1)c1ccc(cc1)OC)c1ccc(cc1)OC
STL330743
Synonyms: 4-[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]benzoicacid
Smiles: COc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)OC)c1ccc(cc1)C(=O)O
STL321941
Synonyms: 4-[4,5-bis(azepan-1-ylmethyl)-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-amine
Smiles: Nc1nonc1n1nnc(c1CN1CCCCCC1)CN1CCCCCC1
STL321315
Synonyms: 4-[4,5-bis(piperidin-1-ylmethyl)-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-amine
Smiles: Nc1nonc1n1nnc(c1CN1CCCCC1)CN1CCCCC1
STL335482
Synonyms: 4-[4,5-di(thiophen-2-yl)-1H-imidazol-2-yl]-2-ethoxyphenol
Smiles: CCOc1cc(ccc1O)c1[nH]c(c(n1)c1cccs1)c1cccs1
STL349292
Synonyms: 4-[4,6-dioxo-2-phenyl-3-(2,3,4-trimethoxyphenyl)hexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(c(c1OC)OC)OC
STL338488
Synonyms: 4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2,6-dimethoxyphenylacetate
Smiles: CCCOc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1cc(OC)c(c(c1)OC)OC(=O)C)c1ccccc1
STL344555
Synonyms: 4-[4,6-dioxo-2-phenyl-5-(4-propoxyphenyl)hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenylbenzoate
Smiles: CCCOc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1ccc(cc1)OC(=O)c1ccccc1)c1ccccc1
STL321491
Synonyms: 4-[4,6-dioxo-3-(pyrazin-2-ylcarbonyl)-3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(=NN2)C(=O)c1cnccn1
STL343694
Synonyms: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7-methyl-5H-pyrimido[5,4-b]indole
Smiles: Cc1ccc2c(c1)[nH]c1c2ncnc1N1CCN(CC1)Cc1ccc2c(c1)OCO2
STL342775
Synonyms: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-8-ethoxy-5H-pyrimido[5,4-b]indole
Smiles: CCOc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)Cc1ccc2c(c1)OCO2
STL348977
Synonyms: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-8-methoxy-5-methyl-5H-pyrimido[5,4-b]indole
Smiles: COc1ccc2c(c1)c1ncnc(c1n2C)N1CCN(CC1)Cc1ccc2c(c1)OCO2
STL349256
Synonyms: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-9-chloro-5H-pyrimido[5,4-b]indole
Smiles: Clc1cccc2c1c1ncnc(c1[nH]2)N1CCN(CC1)Cc1ccc2c(c1)OCO2
STL348659
Synonyms: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-9-methoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1cccc2c1c1ncnc(c1[nH]2)N1CCN(CC1)Cc1ccc2c(c1)OCO2
STL352700
Synonyms: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl][1]benzofuro[3,2-d]pyrimidine
Smiles: C1Oc2c(O1)cc(cc2)CN1CCN(CC1)c1ncnc2c1oc1c2cccc1
STL313137
Synonyms: 4-[4-(1,5-dimethyl-1H-pyrazol-4-yl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1cnn(c1C)C)cnn2c1ccc(cc1)C(=O)O
STL315357
Synonyms: 4-[4-(1H-benzimidazol-2-yl)-3-hydroxy-1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridin-6-yl]benzene-1,2,3-triol
Smiles: Oc1ccc(c(c1O)O)c1cc(c2nc3c([nH]2)cccc3)c2c(n1)n(nc2O)C(C)C
STL346355
Synonyms: 4-[4-(1H-benzimidazol-2-ylmethyl)piperazin-1-yl]-2-methyl[1]benzofuro[3,2-d]pyrimidine
Smiles: Cc1nc(N2CCN(CC2)Cc2nc3c([nH]2)cccc3)c2c(n1)c1ccccc1o2
STL311190
Synonyms: 4-[4-(2,3-difluorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1cccc(c1F)F)cnn2c1ccc(cc1)C(=O)O
STL336091
Synonyms: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: COc1ccc(cc1)n1ncc2c1ncnc2N1CCN(CC1)c1cccc(c1C)C
STL352521
Synonyms: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1c(C)cccc1N1CCN(CC1)c1ncnc2c1cnn2c1ccccc1
STL346320
Synonyms: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-8-ethoxy-5H-pyrimido[5,4-b]indole
Smiles: CCOc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)c1cccc(c1C)C
STL344143
Synonyms: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-9-methoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1cccc2c1c1ncnc(c1[nH]2)N1CCN(CC1)c1cccc(c1C)C
STL318098
Synonyms: 4-[4-(2,4-difluorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: Fc1ccc(c(c1)F)C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O
STL343000
Synonyms: 4-[4-(2,4-dimethylphenyl)piperazin-1-yl]-8-fluoro-5H-pyrimido[5,4-b]indole
Smiles: Cc1ccc(c(c1)C)N1CCN(CC1)c1ncnc2c1[nH]c1c2cc(cc1)F
STL336556
Synonyms: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1ccc(c(c1)N1CCN(CC1)c1ncnc2c1cnn2c1cccc(c1)C)C
STL336400
Synonyms: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-1-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: COc1ccc(cc1)n1ncc2c1ncnc2N1CCN(CC1)c1cc(C)ccc1C
STL336183
Synonyms: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1ccc(c(c1)N1CCN(CC1)c1ncnc2c1cnn2c1ccccc1)C
STL346158
Synonyms: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-8-ethoxy-5H-pyrimido[5,4-b]indole
Smiles: CCOc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)c1cc(C)ccc1C
STL342996
Synonyms: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-8-fluoro-5H-pyrimido[5,4-b]indole
Smiles: Fc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)c1cc(C)ccc1C
STL326794
Synonyms: 4-[4-(2,6-dimethoxyphenoxy)butyl]thiomorpholine
Smiles: COc1cccc(c1OCCCCN1CCSCC1)OC
STL315224
Synonyms: 4-[4-(2-chlorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1ccccc1Cl)cnn2c1ccc(cc1)C(=O)O
STL336568
Synonyms: 4-[4-(2-chlorophenyl)piperazin-1-yl]-1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1ccc(c(c1)C)n1ncc2c1ncnc2N1CCN(CC1)c1ccccc1Cl
STL336224
Synonyms: 4-[4-(2-chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: COc1ccc(cc1)n1ncc2c1ncnc2N1CCN(CC1)c1ccccc1Cl
STL345433
Synonyms: 4-[4-(2-chlorophenyl)piperazin-1-yl]-2-methyl[1]benzofuro[3,2-d]pyrimidine
Smiles: Cc1nc(N2CCN(CC2)c2ccccc2Cl)c2c(n1)c1ccccc1o2
STL352704
Synonyms: 4-[4-(2-chlorophenyl)piperazin-1-yl][1]benzofuro[3,2-d]pyrimidine
Smiles: Clc1ccccc1N1CCN(CC1)c1ncnc2c1oc1c2cccc1
STL349259
Synonyms: 4-[4-(2-ethoxyphenyl)piperazin-1-yl]-9-methyl-5H-pyrimido[5,4-b]indole
Smiles: CCOc1ccccc1N1CCN(CC1)c1ncnc2c1[nH]c1c2c(C)ccc1
STL330517
Synonyms: 4-[4-(2-fluorophenoxy)-6-methylpyrimidin-2-yl]morpholine
Smiles: Cc1cc(nc(n1)N1CCOCC1)Oc1ccccc1F
STL312333
Synonyms: 4-[4-(2-fluorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1ccccc1F)cnn2c1ccc(cc1)C(=O)O
STL334993
Synonyms: 4-[4-(2-fluorophenyl)piperazin-1-yl]-6,7-dimethoxy-2-phenylquinazoline
Smiles: COc1cc2c(cc1OC)nc(nc2N1CCN(CC1)c1ccccc1F)c1ccccc1
STL346375
Synonyms: 4-[4-(2-fluorophenyl)piperazin-1-yl]-9-methoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1cccc2c1c1ncnc(c1[nH]2)N1CCN(CC1)c1ccccc1F
STL336582
Synonyms: 4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-nitro-1-phenylquinolin-2(1H)-one
Smiles: OCCN1CCN(CC1)c1c([N+](=O)[O-])c(=O)n(c2c1cccc2)c1ccccc1
STL348932
Synonyms: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-5,8-dimethyl-5H-pyrimido[5,4-b]indole
Smiles: COc1ccccc1N1CCN(CC1)c1ncnc2c1n(C)c1c2cc(cc1)C
STL342742
Synonyms: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-9-methyl-5H-pyrimido[5,4-b]indole
Smiles: COc1ccccc1N1CCN(CC1)c1ncnc2c1[nH]c1c2c(C)ccc1
STL352702
Synonyms: 4-[4-(2-methoxyphenyl)piperazin-1-yl][1]benzofuro[3,2-d]pyrimidine
Smiles: COc1ccccc1N1CCN(CC1)c1ncnc2c1oc1c2cccc1
STL325329
Synonyms: 4-[4-(2-methyl-1,3-thiazol-4-yl)-5-(trifluoromethyl)-1,2-oxazol-3-yl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)c1noc(c1c1csc(n1)C)C(F)(F)F
STL323436
Synonyms: 4-[4-(2-methyl-1,3-thiazol-4-yl)-5-(trifluoromethyl)-1H-pyrazol-3-yl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)c1n[nH]c(c1c1csc(n1)C)C(F)(F)F
STL320464
Synonyms: 4-[4-(2-methylpropoxy)phenyl]-1-(propan-2-yl)-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridine-3,7-diol
Smiles: CC(COc1ccc(cc1)c1c2oc3c(c2nc2c1c(O)nn2C(C)C)ccc(c3)O)C
STL316300
Synonyms: 4-[4-(2-phenylethoxy)phenyl]-1-(propan-2-yl)-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridine-3,6,7-triol
Smiles: CC(n1nc(c2c1nc1c(c2c2ccc(cc2)OCCc2ccccc2)oc2c1ccc(c2O)O)O)C
STL336874
Synonyms: 4-[4-(2-tert-butyl-4-ethyl-6-nitrophenoxy)-3,5,6-trifluoropyridin-2-yl]morpholine
Smiles: CCc1cc([N+](=O)[O-])c(c(c1)C(C)(C)C)Oc1c(F)c(F)nc(c1F)N1CCOCC1
STL336150
Synonyms: 4-[4-(3,4-dichlorophenyl)piperazin-1-yl]-1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1ccc(c(c1)C)n1ncc2c1ncnc2N1CCN(CC1)c1ccc(c(c1)Cl)Cl
STL345035
Synonyms: 4-[4-(3,4-dichlorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1cc2c(cc1OC)[nH]c1c2ncnc1N1CCN(CC1)c1ccc(c(c1)Cl)Cl
STL314681
Synonyms: 4-[4-(3,4-difluorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1ccc(c(c1)F)F)cnn2c1ccc(cc1)C(=O)O
STL307888
Synonyms: 4-[4-(3,5-dimethyl-1H-pyrazol-1-yl)-2,3,5,6-tetrafluorobenzyl]morpholine
Smiles: Cc1nn(c(c1)C)c1c(F)c(F)c(c(c1F)F)CN1CCOCC1
STL330008
Synonyms: 4-[4-(3,5-diphenyl-1H-pyrazol-1-yl)-2,3,5,6-tetrafluorobenzyl]morpholine
Smiles: Fc1c(F)c(CN2CCOCC2)c(c(c1n1nc(cc1c1ccccc1)c1ccccc1)F)F
STL337838
Synonyms: 4-[4-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)phenyl]-2,6-diphenylthiopyranium
Smiles: c1ccc(cc1)C1CC(=NN1c1ccc(cc1)c1cc([s+]c(c1)c1ccccc1)c1ccccc1)c1ccccc1
STL309614
Synonyms: 4-[4-(3-chlorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: Clc1cccc(c1)C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O
STL336676
Synonyms: 4-[4-(3-chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: COc1ccc(cc1)n1ncc2c1ncnc2N1CCN(CC1)c1cccc(c1)Cl
STL360840
Synonyms: 4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxo-N-(pyridin-2-ylmethyl)butanamide
Smiles: O=C(NCc1ccccn1)CCC(=O)N1CCN(CC1)c1cccc(c1)Cl
STL313676
Synonyms: 4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxo-N-(pyridin-3-ylmethyl)butanamide
Smiles: O=C(CCC(=O)N1CCN(CC1)c1cccc(c1)Cl)NCc1cccnc1
STL313849
Synonyms: 4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxo-N-(pyridin-4-ylmethyl)butanamide
Smiles: O=C(CCC(=O)N1CCN(CC1)c1cccc(c1)Cl)NCc1ccncc1
STL319731
Synonyms: 4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxo-N-[2-(pyridin-2-yl)ethyl]butanamide
Smiles: O=C(CCC(=O)N1CCN(CC1)c1cccc(c1)Cl)NCCc1ccccn1
STL343349
Synonyms: 4-[4-(3-chlorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1cc2c(cc1OC)[nH]c1c2ncnc1N1CCN(CC1)c1cccc(c1)Cl
STL348914
Synonyms: 4-[4-(3-chlorophenyl)piperazin-1-yl]-9-methoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1cccc2c1c1ncnc(c1[nH]2)N1CCN(CC1)c1cccc(c1)Cl
STL352693
Synonyms: 4-[4-(3-chlorophenyl)piperazin-1-yl][1]benzofuro[3,2-d]pyrimidine
Smiles: Clc1cccc(c1)N1CCN(CC1)c1ncnc2c1oc1c2cccc1
STL336394
Synonyms: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: COc1cccc(c1)N1CCN(CC1)c1ncnc2c1cnn2c1cccc(c1)C
STL319098
Synonyms: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-9-methyl-5H-pyrimido[5,4-b]indole
Smiles: COc1cccc(c1)N1CCN(CC1)c1ncnc2c1[nH]c1c2c(C)ccc1
STL322206
Synonyms: 4-[4-(3-methyl-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl)phenyl]-2,6-diphenylpyranium
Smiles: CC1=NN(C(C1)c1ccccc1)c1ccc(cc1)c1cc([o+]c(c1)c1ccccc1)c1ccccc1
STL343391
Synonyms: 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methyl[1]benzofuro[3,2-d]pyrimidine
Smiles: Cc1cc(C)nc(n1)N1CCN(CC1)c1nc(C)nc2c1oc1c2cccc1
STL353243
Synonyms: 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl][1]benzofuro[3,2-d]pyrimidine
Smiles: Cc1cc(C)nc(n1)N1CCN(CC1)c1ncnc2c1oc1c2cccc1
STL343167
Synonyms: 4-[4-(4-chlorobenzyl)piperazin-1-yl]-2-methyl[1]benzofuro[3,2-d]pyrimidine
Smiles: Clc1ccc(cc1)CN1CCN(CC1)c1nc(C)nc2c1oc1c2cccc1
STL305060
Synonyms: 4-[4-(4-chlorophenyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine
Smiles: Clc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1c1ccncc1
STL320476
Synonyms: 4-[4-(4-chlorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: Clc1ccc(cc1)C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O
STL343718
Synonyms: 4-[4-(4-chlorophenyl)piperazin-1-yl]-2-methyl[1]benzofuro[3,2-d]pyrimidine
Smiles: Clc1ccc(cc1)N1CCN(CC1)c1nc(C)nc2c1oc1c2cccc1
STL335068
Synonyms: 4-[4-(4-chlorophenyl)piperazin-1-yl]-6,7-dimethoxy-2-phenylquinazoline
Smiles: COc1cc2c(cc1OC)nc(nc2N1CCN(CC1)c1ccc(cc1)Cl)c1ccccc1
STL343727
Synonyms: 4-[4-(4-chlorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1cc2c(cc1OC)[nH]c1c2ncnc1N1CCN(CC1)c1ccc(cc1)Cl
STL334083
Synonyms: 4-[4-(4-chlorophenyl)piperazin-1-yl]-8-fluoro-5H-pyrimido[5,4-b]indole
Smiles: Clc1ccc(cc1)N1CCN(CC1)c1ncnc2c1[nH]c1c2cc(cc1)F
STL352697
Synonyms: 4-[4-(4-chlorophenyl)piperazin-1-yl][1]benzofuro[3,2-d]pyrimidine
Smiles: Clc1ccc(cc1)N1CCN(CC1)c1ncnc2c1oc1c2cccc1
STL315294
Synonyms: 4-[4-(4-cyanophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: N#Cc1ccc(cc1)C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O
STL357371
Synonyms: 4-[4-(4-ethoxybenzyl)piperazin-1-yl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: CCOc1ccc(cc1)CN1CCN(CC1)c1ncnc2c1c1CCCCc1s2
STL342960
Synonyms: 4-[4-(4-fluorophenyl)-3,6-dihydropyridin-1(2H)-yl]-9-methyl-5H-pyrimido[5,4-b]indole
Smiles: Fc1ccc(cc1)C1=CCN(CC1)c1ncnc2c1[nH]c1c2c(C)ccc1
STL314813
Synonyms: 4-[4-(4-fluorophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: Fc1ccc(cc1)C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O
STL336565
Synonyms: 4-[4-(4-fluorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: COc1ccc(cc1)n1ncc2c1ncnc2N1CCN(CC1)c1ccc(cc1)F
STL311006
Synonyms: 4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-N-(4H-1,2,4-triazol-3-yl)butanamide
Smiles: O=C(N1CCN(CC1)c1ccc(cc1)F)CCC(=O)Nc1[nH]cnn1
STL335676
Synonyms: 4-[4-(4-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1cc2c(cc1OC)[nH]c1c2ncnc1N1CCN(CC1)c1ccc(cc1)F
STL344191
Synonyms: 4-[4-(4-fluorophenyl)piperazin-1-yl]-9-methoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1cccc2c1c1ncnc(c1[nH]2)N1CCN(CC1)c1ccc(cc1)F
STL350650
Synonyms: 4-[4-(4-fluorophenyl)piperazin-1-yl]tetrahydrothiophene-3-ol1,1-dioxide
Smiles: OC1CS(=O)(=O)CC1N1CCN(CC1)c1ccc(cc1)F
STL352583
Synonyms: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Smiles: COc1ccc(cc1)N1CCN(CC1)c1ncnc2c1cnn2c1ccccc1
STL323493
Synonyms: 4-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-1-oxaspiro[4.5]decan-2-one
Smiles: O=C1CC(C2(O1)CCCCC2)c1scc(n1)c1ccc(cc1)[N+](=O)[O-]
STL321967
Synonyms: 4-[4-(4-nitrophenyl)-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1C(=O)CC(C2=C1CCCC2=O)c1ccc(cc1)[N+](=O)[O-]
STL334301
Synonyms: 4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-6,7-dimethoxy-2-phenylquinazoline
Smiles: COc1cc2c(cc1OC)nc(nc2N1CCN(CC1)c1cc(Cl)ccc1C)c1ccccc1
STL319887
Synonyms: 4-[4-(azepan-1-ylmethyl)-7-methylfuro[2,3-c]pyridin-2-yl]-6,7-dimethyl-2H-chromen-2-one
Smiles: O=c1oc2cc(C)c(cc2c(c1)c1cc2c(o1)c(C)ncc2CN1CCCCCC1)C
STL316936
Synonyms: 4-[4-(azepan-1-ylmethyl)-7-methylfuro[2,3-c]pyridin-2-yl]-7,8-dimethyl-2H-chromen-2-one
Smiles: O=c1cc(c2cc3c(o2)c(C)ncc3CN2CCCCCC2)c2c(o1)c(C)c(cc2)C
STL317371
Synonyms: 4-[4-(azepan-1-ylmethyl)-7-methylfuro[2,3-c]pyridin-2-yl]-7-methyl-2H-chromen-2-one
Smiles: Cc1ccc2c(c1)oc(=O)cc2c1cc2c(o1)c(C)ncc2CN1CCCCCC1
STL331051
Synonyms: 4-[4-(benzyloxy)but-2-yn-1-yl]morpholine
Smiles: O1CCN(CC1)CC#CCOCc1ccccc1
STL313057
Synonyms: 4-[4-(benzyloxy)phenyl]-1-(propan-2-yl)-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridine-3,6,7-triol
Smiles: Oc1ccc2c(c1O)oc1c2nc2c(c1c1ccc(cc1)OCc1ccccc1)c(nn2C(C)C)O
STL311865
Synonyms: 4-[4-(benzyloxy)phenyl]-1-(propan-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7-diol
Smiles: OC1=Nc2n(nc(c2C(SC1)c1ccc(cc1)OCc1ccccc1)O)C(C)C
STL320873
Synonyms: 4-[4-(diethylamino)phenyl]-7,7-dimethyl-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: CCN(c1ccc(cc1)C1CC(=O)NC2=C1C(=O)CC(C2)(C)C)CC
STL313532
Synonyms: 4-[4-(difluoromethoxy)-3-methoxybenzyl]-6-phenylpyridazin-3-ol
Smiles: COc1cc(ccc1OC(F)F)Cc1cc(nnc1O)c1ccccc1
STL316401
Synonyms: 4-[4-(difluoromethoxy)-3-methoxyphenyl]-1-(propan-2-yl)-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridine-3,6,7-triol
Smiles: COc1cc(ccc1OC(F)F)c1c2oc3c(c2nc2c1c(O)nn2C(C)C)ccc(c3O)O
STL309328
Synonyms: 4-[4-(difluoromethoxy)-3-methoxyphenyl]-3-hydroxy-5-methyl-1-(propan-2-yl)-5,7-dihydroimidazo[4,5-b]pyrazolo[4,3-e]pyridin-6(1H)-one
Smiles: COc1cc(ccc1OC(F)F)c1c2c([nH]c(=O)n2C)nc2c1c(O)nn2C(C)C
STL315468
Synonyms: 4-[4-(difluoromethoxy)-3-methoxyphenyl]-5-hydroxy-7-methyl-3,4-dihydro-2H-pyrano[3,2-c]pyridin-2-one
Smiles: COc1cc(ccc1OC(F)F)C1CC(=O)Oc2c1c(O)nc(c2)C
STL327024
Synonyms: 4-[4-(dimethylamino)phenyl]-1-methylpyridinium
Smiles: C[n+]1ccc(cc1)c1ccc(cc1)N(C)C
STL330275
Synonyms: 4-[4-(dimethylamino)phenyl]-2-(3-iodophenyl)-6H-1,3-oxazin-6-one
Smiles: Ic1cccc(c1)c1oc(=O)cc(n1)c1ccc(cc1)N(C)C
STL330302
Synonyms: 4-[4-(dimethylamino)phenyl]-2-(3-nitrophenyl)-6H-1,3-oxazin-6-one
Smiles: O=c1cc(nc(o1)c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)N(C)C
STL308251
Synonyms: 4-[4-(dimethylamino)phenyl]-3,4,5,6-tetrahydrobenzo[h]quinazoline-2(1H)-thione
Smiles: S=C1NC(c2ccc(cc2)N(C)C)C2=C(N1)c1ccccc1CC2
STL352000
Synonyms: 4-[4-(dimethylamino)phenyl]-5-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-6-methyl-3,4-dihydropyrimidine-2(1H)-thione
Smiles: COc1ccc(cc1)c1noc(n1)C1=C(C)NC(=S)NC1c1ccc(cc1)N(C)C
STL323935
Synonyms: 4-[4-(dimethylamino)phenyl]-7,7-dimethyl-5-oxo-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#Cc1c(=S)[nH]c2c(c1c1ccc(cc1)N(C)C)C(=O)CC(C2)(C)C
STL323877
Synonyms: 4-[4-(dimethylamino)phenyl]-7,7-dimethyl-5-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccccc2)nc2c(c1c1ccc(cc1)N(C)C)C(=O)CC(C2)(C)C
STL331661
Synonyms: 4-[4-(diphenylmethoxy)but-2-yn-1-yl]-4-(prop-2-en-1-yl)morpholin-4-ium
Smiles: C=CC[N+]1(CCOCC1)CC#CCOC(c1ccccc1)c1ccccc1
STL326449
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Smiles: c1ccc(cc1)C(c1ccccc1)N1CCN(CC1)c1ncnc2c1cnn2c1ccccc1
STL343387
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-2-(ethylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCSc1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C
STL342574
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CSc1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C
STL345533
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-6,6-dimethyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CC(Sc1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C)C
STL344409
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-6,6-dimethyl-2-(propylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCCSc1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C
STL347619
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-6-(morpholin-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Smiles: O1CCN(CC1)c1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)n(nc2)c1ccccc1
STL303896
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-6-ethyl-2-(ethylsulfanyl)-6-methyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCSc1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)CC
STL323485
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-6-ethylthieno[2,3-d]pyrimidine
Smiles: CCc1sc2c(c1)c(ncn2)N1CCN(CC1)C(c1ccccc1)c1ccccc1
STL348080
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-6-hydrazinyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Smiles: NNc1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)n(nc2)c1ccccc1
STL342131
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-7-methoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1ccc2c(c1)[nH]c1c2ncnc1N1CCN(CC1)C(c1ccccc1)c1ccccc1
STL345659
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC1(C)OCc2c(C1)nc1c(c2)c2c(s1)c(ncn2)N1CCN(CC1)C(c1ccccc1)c1ccccc1
STL325154
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxaline
Smiles: c1ccc(cc1)C(c1ccccc1)N1CCN(CC1)c1nc2ccccc2n2c1nnc2
STL321297
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl][1]benzofuro[3,2-d]pyrimidine
Smiles: c1ccc(cc1)C(c1ccccc1)N1CCN(CC1)c1ncnc2c1oc1c2cccc1
STL326317
Synonyms: 4-[4-(diphenylphosphoryl)-2-phenyl-1,3-oxazol-5-yl]morpholine
Smiles: O=P(c1nc(oc1N1CCOCC1)c1ccccc1)(c1ccccc1)c1ccccc1
STL334545
Synonyms: 4-[4-(ethylsulfanyl)-3,6-dihydro-1,3,5-triazin-1(2H)-yl]butanoicacid
Smiles: CCSC1=NCN(CN1)CCCC(=O)O
STL315080
Synonyms: 4-[4-(methylsulfanyl)phenyl]-1-(propan-2-yl)-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridine-3,6,7-triol
Smiles: CSc1ccc(cc1)c1c2oc3c(c2nc2c1c(O)nn2C(C)C)ccc(c3O)O
STL310856
Synonyms: 4-[4-(methylsulfanyl)phenyl]-1-(thiophen-2-ylmethyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: CSc1ccc(cc1)C1SCC(=Nc2c1cnn2Cc1cccs1)O
STL364124
Synonyms: 4-[4-(morpholin-4-yl)phthalazin-1-yl]phenol
Smiles: Oc1ccc(cc1)c1nnc(c2c1cccc2)N1CCOCC1
STL296667
Synonyms: 4-[4-(prop-2-en-1-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]-1-propoxybutan-2-ol
Smiles: CCCOCC(CCc1nnc(n1CC=C)S)O
STL345553
Synonyms: 4-[4-(pyridin-2-yl)piperazin-1-yl]-5H-pyrimido[5,4-b]indole
Smiles: c1ccc(nc1)N1CCN(CC1)c1ncnc2c1[nH]c1c2cccc1
STL314308
Synonyms: 4-[4-(pyridin-2-ylmethoxy)phenyl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2[nH]ncc2C(SC1)c1ccc(cc1)OCc1ccccn1
STL333176
Synonyms: 4-[4-(pyrimidin-2-yl)piperazin-1-yl][1]benzofuro[3,2-d]pyrimidine
Smiles: c1cnc(nc1)N1CCN(CC1)c1ncnc2c1oc1c2cccc1
STL342375
Synonyms: 4-[4-cyano-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]-N-phenylpiperazine-1-carbothioamide
Smiles: N#Cc1c(nc(c2c1CCCC2)C(C)C)N1CCN(CC1)C(=S)Nc1ccccc1
STL352359
Synonyms: 4-[4-ethyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]aniline
Smiles: CSc1nnc(n1CC)c1ccc(cc1)N
STL313444
Synonyms: 4-[4-methoxy-3-(methoxymethyl)phenyl]-3-methyl-1-phenyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: COCc1cc(ccc1OC)C1SCC(=Nc2c1c(C)nn2c1ccccc1)O
STL329865
Synonyms: 4-[4-methyl-6-(4-methyl-1H-pyrazol-1-yl)-5-nitropyrimidin-2-yl]morpholine
Smiles: Cc1cnn(c1)c1nc(nc(c1[N+](=O)[O-])C)N1CCOCC1
STL302133
Synonyms: 4-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)C1SCC(=O)N1CCc1ccccc1
STL314050
Synonyms: 4-[5-(1,2-dithiolan-3-yl)pentanoyl]-N,N-dimethylpiperazine-1-sulfonamide
Smiles: CN(S(=O)(=O)N1CCN(CC1)C(=O)CCCCC1CCSS1)C
STL311308
Synonyms: 4-[5-(1,3-benzodioxol-5-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc2c(c1)OCO2)c1ccccc1
STL349398
Synonyms: 4-[5-(2,4-dimethylphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1C)C)c1ccccc1
STL330772
Synonyms: 4-[5-(2,5-dimethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccc(cc1C1CC(=NN1C(=O)CCC(=O)O)c1ccc(cc1)C)OC
STL349126
Synonyms: 4-[5-(2,6-dichlorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzamide
Smiles: O=C1C2C(C(=O)N1c1c(Cl)cccc1Cl)ON(C2c1ccc(cc1)C(=O)N)c1ccccc1
STL311491
Synonyms: 4-[5-(2-aminoethyl)-1,2,4-oxadiazol-3-yl]-N,N-dimethylaniline
Smiles: NCCc1onc(n1)c1ccc(cc1)N(C)C
STL333661
Synonyms: 4-[5-(2-chloro-6,7-dimethoxyquinolin-3-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1cc2cc(c(nc2cc1OC)Cl)C1CC(=NN1C(=O)CCC(=O)O)c1ccccc1
STL336451
Synonyms: 4-[5-(2-chloro-6-methoxyquinolin-3-yl)-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)C1CC(=NN1C(=O)CCC(=O)O)c1ccco1
STL336440
Synonyms: 4-[5-(2-chloro-6-methylquinolin-3-yl)-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cc2cc(C)ccc2nc1Cl)c1ccco1
STL331098
Synonyms: 4-[5-(2-chloro-7-methoxyquinolin-3-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1cc2ccc(cc2nc1Cl)OC)C(=O)CCC(=O)O
STL336276
Synonyms: 4-[5-(2-chloro-7-methoxyquinolin-3-yl)-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccc2c(c1)nc(c(c2)C1CC(=NN1C(=O)CCC(=O)O)c1ccco1)Cl
STL331399
Synonyms: 4-[5-(2-chloro-7-methoxyquinolin-3-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccc2c(c1)nc(c(c2)C1CC(=NN1C(=O)CCC(=O)O)c1ccccc1)Cl
STL336154
Synonyms: 4-[5-(2-chloro-7-methylquinolin-3-yl)-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cc2ccc(cc2nc1Cl)C)c1ccco1
STL329573
Synonyms: 4-[5-(2-chlorophenyl)-3-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccccc1C1=NN(C(C1)c1ccccc1Cl)C(=O)CCC(=O)O
STL331338
Synonyms: 4-[5-(2-chlorophenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1cc(ccc1OC)C1=NN(C(C1)c1ccccc1Cl)C(=O)CCC(=O)O
STL309558
Synonyms: 4-[5-(2-chlorophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1ccccc1Cl)C(=O)CCC(=O)O
STL336873
Synonyms: 4-[5-(2-chlorophenyl)-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccccc1Cl)c1ccco1
STL346863
Synonyms: 4-[5-(2-chlorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccccc1Cl)c1ccccc1
STL342568
Synonyms: 4-[5-(2-chlorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenylbenzoate
Smiles: O=C(c1ccccc1)Oc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccccc1Cl)c1ccccc1
STL316735
Synonyms: 4-[5-(2-fluorophenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccccc1F)c1ccccc1
STL346676
Synonyms: 4-[5-(2-methylphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenyl1-methyl-1H-pyrazole-5-carboxylate
Smiles: O=C1C2C(c3ccc(cc3)OC(=O)c3ccnn3C)N(OC2C(=O)N1c1ccccc1C)c1ccccc1
STL335733
Synonyms: 4-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-phenylquinoline
Smiles: COc1cc(ccc1OC)c1nnc(o1)c1cc(nc2c1cccc2)c1ccccc1
STL324896
Synonyms: 4-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]pyridine
Smiles: COc1cc(ccc1OC)c1nnc(o1)c1ccncc1
STL309550
Synonyms: 4-[5-(3-aminopropyl)-1,2,4-oxadiazol-3-yl]-N,N-dimethylaniline
Smiles: NCCCc1onc(n1)c1ccc(cc1)N(C)C
STL343690
Synonyms: 4-[5-(3-chlorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenylbenzoate
Smiles: Clc1cccc(c1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(cc1)OC(=O)c1ccccc1
STL344859
Synonyms: 4-[5-(3-methylphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenylbenzoate
Smiles: Cc1cccc(c1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(cc1)OC(=O)c1ccccc1
STL337004
Synonyms: 4-[5-(4-bromophenyl)-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)Br)c1ccco1
STL328927
Synonyms: 4-[5-(4-chlorophenyl)-1,3-thiazol-2-yl]-7,7-dimethyl-1-oxa-8-thiaspiro[4.5]decan-2-one
Smiles: O=C1CC(C2(O1)CCSC(C2)(C)C)c1ncc(s1)c1ccc(cc1)Cl
STL336715
Synonyms: 4-[5-(4-ethylphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: CCc1ccc(cc1)C1CC(=NN1C(=O)CCC(=O)O)c1ccccc1
STL336187
Synonyms: 4-[5-(4-fluorophenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)F)c1ccccc1
STL343633
Synonyms: 4-[5-(4-fluorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2-methoxyphenyl1-methyl-1H-pyrazole-5-carboxylate
Smiles: COc1cc(ccc1OC(=O)c1ccnn1C)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)F)c1ccccc1
STL300813
Synonyms: 4-[5-(4-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-N,N-dimethylaniline
Smiles: Fc1ccc(cc1)C1=CC(n2c(N1)ncn2)c1ccc(cc1)N(C)C
STL352912
Synonyms: 4-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]pyridine
Smiles: COc1ccc(cc1)c1nnc(o1)c1ccncc1
STL298106
Synonyms: 4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]pyridine
Smiles: Cc1ccc(cc1)c1nnc(o1)c1ccncc1
STL336303
Synonyms: 4-[5-(7-chloro-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-8-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cc2cc3OCCOc3cc2nc1Cl)c1ccc(cc1)C
STL335170
Synonyms: 4-[5-(7-chloro-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-8-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cc2cc3OCCOc3cc2nc1Cl)c1ccccc1
STL312840
Synonyms: 4-[5-(7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl)furan-2-yl]benzenesulfonamide
Smiles: OC1=Nc2[nH]ncc2C(SC1)c1ccc(o1)c1ccc(cc1)S(=O)(=O)N
STL313889
Synonyms: 4-[5-(7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl)furan-2-yl]benzoicacid
Smiles: OC1=Nc2[nH]ncc2C(SC1)c1ccc(o1)c1ccc(cc1)C(=O)O
STL298635
Synonyms: 4-[5-(aminomethyl)-1,2,4-oxadiazol-3-yl]-N,N-dimethylaniline
Smiles: NCc1onc(n1)c1ccc(cc1)N(C)C
STL326953
Synonyms: 4-[5-(bromomethyl)-4,5-dihydro-1,2-oxazol-3-yl]-2,6-di-tert-butylphenol
Smiles: BrCC1ON=C(C1)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
STL323797
Synonyms: 4-[5-(chloromethyl)-2-imino-1,3-oxazolidin-3-yl]-6-(methylsulfanyl)-N-(propan-2-yl)-1,3,5-triazin-2-amine
Smiles: ClCC1CN(C(=N)O1)c1nc(SC)nc(n1)NC(C)C
STL336255
Synonyms: 4-[5-(furan-2-yl)-3-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccccc1C1=NN(C(C1)c1ccco1)C(=O)CCC(=O)O
STL364029
Synonyms: 4-[5-({2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-1H-tetrazol-1-yl]benzoicacid
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnnn1c1ccc(cc1)C(=O)O
STL344453
Synonyms: 4-[5-benzyl-2-(4-chlorophenyl)-4,6-dioxohexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenylbenzoate
Smiles: Clc1ccc(cc1)N1OC2C(C1c1ccc(cc1)OC(=O)c1ccccc1)C(=O)N(C2=O)Cc1ccccc1
STL332609
Synonyms: 4-[5-chloro-2-(3-methylbutoxy)benzyl]morpholine
Smiles: CC(CCOc1ccc(cc1CN1CCOCC1)Cl)C
STL332678
Synonyms: 4-[5-chloro-2-(pentyloxy)benzyl]morpholine
Smiles: CCCCCOc1ccc(cc1CN1CCOCC1)Cl
STL297898
Synonyms: 4-[5-chloro-4-(4-chloro-2,6-dimethylphenoxy)-3,6-difluoropyridin-2-yl]morpholine
Smiles: Clc1cc(C)c(c(c1)C)Oc1c(Cl)c(F)nc(c1F)N1CCOCC1
STL315827
Synonyms: 4-[5-hydroxy-1-(3-methoxyphenyl)-6,8-dihydro-1H-imidazo[4,5-e][1,4]thiazepin-8-yl]benzoicacid
Smiles: COc1cccc(c1)n1cnc2c1C(SCC(=N2)O)c1ccc(cc1)C(=O)O
STL352658
Synonyms: 4-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-4-oxobutanoicacid
Smiles: COc1cc2CCN(C(c2cc1OC)c1cccc(c1)[N+](=O)[O-])C(=O)CCC(=O)O
STL336823
Synonyms: 4-[6-(3,5-dimethyl-1H-pyrazol-1-yl)pyrimidin-4-yl]morpholine
Smiles: Cc1cc(n(n1)c1ncnc(c1)N1CCOCC1)C
STL320042
Synonyms: 4-[6-(3,5-dimethyl-1H-pyrazol-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-[(2E)-1,3-thiazol-2(3H)-ylidene]butanamide
Smiles: O=C(/N=c\1/scc[nH]1)CCCc1nnc2n1nc(cc2)n1nc(cc1C)C
STL363321
Synonyms: 4-[6-(acetylamino)-2H-1,3-benzoxazin-3(4H)-yl]benzoicacid
Smiles: CC(=O)Nc1ccc2c(c1)CN(CO2)c1ccc(cc1)C(=O)O
STL350842
Synonyms: 4-[6-(benzyloxy)-2-methyl-4-oxoquinazolin-3(4H)-yl]-N-(2-methoxyethyl)benzamide
Smiles: COCCNC(=O)c1ccc(cc1)n1c(C)nc2c(c1=O)cc(cc2)OCc1ccccc1
STL314687
Synonyms: 4-[6-(morpholin-4-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]butanoicacid
Smiles: OC(=O)CCCc1nnc2n1nc(cc2)N1CCOCC1
STL320285
Synonyms: 4-[6-(piperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]butanoicacid
Smiles: OC(=O)CCCc1nnc2n1nc(cc2)N1CCCCC1
STL318508
Synonyms: 4-[6-(pyrrolidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]butanoicacid
Smiles: OC(=O)CCCc1nnc2n1nc(cc2)N1CCCC1
STL311413
Synonyms: 4-[6-(thiomorpholin-4-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]butanoicacid
Smiles: OC(=O)CCCc1nnc2n1nc(cc2)N1CCSCC1
STL353304
Synonyms: 4-[6-bromo-4-(2-chlorophenyl)quinolin-2-yl]phenol
Smiles: Oc1ccc(cc1)c1nc2ccc(cc2c(c1)c1ccccc1Cl)Br
STL323540
Synonyms: 4-[6-chloro-2-(methylsulfanyl)-5-(4-propoxybenzyl)pyrimidin-4-yl]morpholine
Smiles: CCCOc1ccc(cc1)Cc1c(Cl)nc(nc1N1CCOCC1)SC
STL318678
Synonyms: 4-[6-hydroxy-3-oxo-1-(tetrahydro-2H-pyran-4-yl)-2,3,4,5-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzoicacid
Smiles: OC1=Nc2c(C(C1)c1ccc(cc1)C(=O)O)c(=O)[nH]n2C1CCOCC1
STL345738
Synonyms: 4-[7-(2,4-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Smiles: Oc1ccc(cc1)c1nc2n(n1)cnc1c2cnn1c1ccc(cc1C)C
STL343099
Synonyms: 4-[7-(2,4-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]phenol
Smiles: Oc1ccc(cc1)c1nnc2n1cnc1c2cnn1c1ccc(cc1C)C
STL345944
Synonyms: 4-[7-(3,4-dichlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)c1nc2n(n1)cnc1c2cnn1c1ccc(c(c1)Cl)Cl
STL345099
Synonyms: 4-[7-(3,4-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)c1nc2n(n1)cnc1c2cnn1c1ccc(c(c1)C)C
STL352581
Synonyms: 4-[7-(3,4-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Smiles: Oc1ccc(cc1)c1nc2n(n1)cnc1c2cnn1c1ccc(c(c1)C)C
STL344407
Synonyms: 4-[7-(3-chloro-4-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)c1nc2n(n1)cnc1c2cnn1c1ccc(c(c1)Cl)C
STL342391
Synonyms: 4-[7-(3-chloro-4-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Smiles: Oc1ccc(cc1)c1nc2n(n1)cnc1c2cnn1c1ccc(c(c1)Cl)C
STL342445
Synonyms: 4-[7-(3-chloro-4-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]phenol
Smiles: Oc1ccc(cc1)c1nnc2n1cnc1c2cnn1c1ccc(c(c1)Cl)C
STL343697
Synonyms: 4-[7-(3-chlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]phenol
Smiles: Oc1ccc(cc1)c1nnc2n1cnc1c2cnn1c1cccc(c1)Cl
STL352555
Synonyms: 4-[7-(4-chlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Smiles: Oc1ccc(cc1)c1nc2n(n1)cnc1c2cnn1c1ccc(cc1)Cl
STL345253
Synonyms: 4-[7-(4-chlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]phenol
Smiles: Oc1ccc(cc1)c1nnc2n1cnc1c2cnn1c1ccc(cc1)Cl
STL342985
Synonyms: 4-[7-(4-fluorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Smiles: Oc1ccc(cc1)c1nc2n(n1)cnc1c2cnn1c1ccc(cc1)F
STL342406
Synonyms: 4-[7-(4-fluorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]phenol
Smiles: Oc1ccc(cc1)c1nnc2n1cnc1c2cnn1c1ccc(cc1)F
STL345552
Synonyms: 4-[7-(5-chloro-2-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Smiles: Oc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1cc(Cl)ccc1C
STL319893
Synonyms: 4-[7-hydroxy-1-(4-methoxyphenyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzoicacid
Smiles: COc1ccc(cc1)n1ncc2c1N=C(O)CSC2c1ccc(cc1)C(=O)O
STL320470
Synonyms: 4-[7-hydroxy-1-(thiophen-2-ylmethyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzoicacid
Smiles: OC1=Nc2n(ncc2C(SC1)c1ccc(cc1)C(=O)O)Cc1cccs1
STL314213
Synonyms: 4-[7-hydroxy-3-methyl-1-(pyridin-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1ccc(cc1)C(=O)O)c(nn2c1ccccn1)C
STL312625
Synonyms: 4-[7-hydroxy-3-methyl-1-(pyridin-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)C1SCC(=Nc2c1c(C)nn2c1ccccn1)O
STL312484
Synonyms: 4-[7-hydroxy-4-(1,3,5-trimethyl-1H-pyrazol-4-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2n(ncc2C(SC1)c1c(C)nn(c1C)C)c1ccc(cc1)C(=O)O
STL309323
Synonyms: 4-[7-hydroxy-4-(1-methyl-1H-pyrazol-4-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1cnn(c1)C)cnn2c1ccc(cc1)C(=O)O
STL310926
Synonyms: 4-[7-hydroxy-4-(2-hydroxypyridin-3-yl)-3-methyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1cccnc1O)c(nn2c1ccc(cc1)C(=O)O)C
STL310404
Synonyms: 4-[7-hydroxy-4-(2-hydroxypyridin-3-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1cccnc1O)cnn2c1ccc(cc1)C(=O)O
STL319458
Synonyms: 4-[7-hydroxy-4-(2-methoxyphenyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: COc1ccccc1C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O
STL315293
Synonyms: 4-[7-hydroxy-4-(2-methylpropyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: CC(CC1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O)C
STL313942
Synonyms: 4-[7-hydroxy-4-(3-methoxyphenyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: COc1cccc(c1)C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O
STL319463
Synonyms: 4-[7-hydroxy-4-(4-methoxyphenyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: COc1ccc(cc1)C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O
STL313008
Synonyms: 4-[7-hydroxy-4-(propan-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: CC(C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O)C
STL314024
Synonyms: 4-[7-hydroxy-4-(pyridin-3-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1cccnc1)cnn2c1ccc(cc1)C(=O)O
STL319884
Synonyms: 4-[7-hydroxy-4-(thiophen-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1cccs1)cnn2c1ccc(cc1)C(=O)O
STL316063
Synonyms: 4-[7-hydroxy-4-(thiophen-3-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1cscc1)cnn2c1ccc(cc1)C(=O)O
STL346959
Synonyms: 4-[8-(1,3-benzodioxol-5-ylcarbamoyl)-9,11-dioxo-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-10(11H)-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)C2C(C1=O)C1N(C2C(=O)Nc2ccc3c(c2)OCO3)C=Cc2c1cccc2
STL347407
Synonyms: 4-[9,11-dioxo-8-(thiophen-2-ylcarbonyl)-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-10(11H)-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)C2C(C1=O)C(N1C2c2ccccc2C=C1)C(=O)c1cccs1
STL325226
Synonyms: 4-[benzyl(1-cyclopropylethyl)amino]-4-oxobutanoicacid
Smiles: CC(N(C(=O)CCC(=O)O)Cc1ccccc1)C1CC1
STL348502
Synonyms: 4-[benzyl(cyclohexyl)sulfamoyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)S(=O)(=O)N(C1CCCCC1)Cc1ccccc1
STL355170
Synonyms: 4-[benzyl(methyl)amino]-1,1-diphenylbut-2-yn-1-ol
Smiles: CN(Cc1ccccc1)CC#CC(c1ccccc1)(c1ccccc1)O
STL329784
Synonyms: 4-[benzyl(propan-2-yl)amino]-1,1-diphenylbut-2-yn-1-ol
Smiles: CC(N(Cc1ccccc1)CC#CC(c1ccccc1)(c1ccccc1)O)C
STL355185
Synonyms: 4-[benzyl(tert-butyl)amino]-1-phenyl-1-(pyridin-3-yl)but-2-yn-1-ol
Smiles: CC(N(Cc1ccccc1)CC#CC(c1cccnc1)(c1ccccc1)O)(C)C
STL327885
Synonyms: 4-[bis(2-hydroxyethyl)amino]-1-cyclopentyl-1-phenylbut-2-yn-1-ol
Smiles: OCCN(CC#CC(c1ccccc1)(C1CCCC1)O)CCO
STL297490
Synonyms: 4-[bis(2-hydroxyethyl)amino]-6-methylpyrimidin-2-ol
Smiles: OCCN(c1cc(C)nc(n1)O)CCO
STL355169
Synonyms: 4-[butyl(2-hydroxyethyl)amino]-1,1-diphenylbut-2-yn-1-ol
Smiles: CCCCN(CC#CC(c1ccccc1)(c1ccccc1)O)CCO
STL323892
Synonyms: 4-[cyano(phenylsulfonyl)methyl]heptanedioicacid
Smiles: N#CC(S(=O)(=O)c1ccccc1)C(CCC(=O)O)CCC(=O)O
STL319693
Synonyms: 4-[N-(4,6-dimethylpyrimidin-2-yl)-beta-alanyl]-N,N-dimethylpiperazine-1-sulfonamide
Smiles: O=C(N1CCN(CC1)S(=O)(=O)N(C)C)CCNc1nc(C)cc(n1)C
STL317239
Synonyms: 4-[N-(4,6-dimethylpyrimidin-2-yl)methionyl]-N,N-dimethylpiperazine-1-sulfonamide
Smiles: CSCCC(C(=O)N1CCN(CC1)S(=O)(=O)N(C)C)Nc1nc(C)cc(n1)C
STL328078
Synonyms: 4-[tert-butyl(2-hydroxyethyl)amino]-1-(1-ethylcyclopentyl)-1-phenylbut-2-yn-1-ol
Smiles: OCCN(C(C)(C)C)CC#CC(C1(CC)CCCC1)(c1ccccc1)O
STL362321
Synonyms: 4-{(1E)-1-[2-({[1-(2-chlorobenzyl)-1H-benzimidazol-2-yl]sulfanyl}acetyl)hydrazinylidene]ethyl}phenylacetate
Smiles: O=C(CSc1nc2c(n1Cc1ccccc1Cl)cccc2)N/N=C(/c1ccc(cc1)OC(=O)C)\C
STL362346
Synonyms: 4-{(1E)-1-[2-({[1-(4-chlorobenzyl)-1H-benzimidazol-2-yl]sulfanyl}acetyl)hydrazinylidene]ethyl}phenylacetate
Smiles: O=C(CSc1nc2c(n1Cc1ccc(cc1)Cl)cccc2)N/N=C(/c1ccc(cc1)OC(=O)C)\C
STL362397
Synonyms: 4-{(1E)-1-[2-({[1-(4-methylbenzyl)-1H-benzimidazol-2-yl]sulfanyl}acetyl)hydrazinylidene]ethyl}phenylacetate
Smiles: O=C(CSc1nc2c(n1Cc1ccc(cc1)C)cccc2)N/N=C(/c1ccc(cc1)OC(=O)C)\C
STL308014
Synonyms: 4-{(1E)-1-[2-({[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetyl)hydrazinylidene]ethyl}phenylacetate
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C(/c1ccc(cc1)OC(=O)C)\C
STL338035
Synonyms: 4-{(1E)-1-[2-({[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetyl)hydrazinylidene]ethyl}phenylacetate
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C(/c2ccc(cc2)OC(=O)C)\C)nc2c(c1=O)cccc2
STL362600
Synonyms: 4-{(1E)-1-[2-({[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]ethyl}phenylacetate
Smiles: COc1ccc(cc1)c1nnc(n1CC)SCC(=O)N/N=C(/c1ccc(cc1)OC(=O)C)\C
STL297753
Synonyms: 4-{(1E)-3-[(2-hydroxyethyl)amino]-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenyl4-methylbenzenesulfonate
Smiles: OCCNC(=O)/C(=C\c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/NC(=O)c1ccccc1
STL298022
Synonyms: 4-{(1E)-3-[(3-hydroxypropyl)amino]-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenyl4-methylbenzenesulfonate
Smiles: OCCCNC(=O)/C(=C\c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/NC(=O)c1ccccc1
STL297545
Synonyms: 4-{(1E)-3-[(4-methoxyphenyl)amino]-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenyl4-methylbenzenesulfonate
Smiles: COc1ccc(cc1)NC(=O)/C(=C\c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/NC(=O)c1ccccc1
STL334912
Synonyms: 4-{(1E)-3-[(5-benzyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl)amino]-2-cyano-3-oxoprop-1-en-1-yl}phenyl4-methylbenzoate
Smiles: N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)C)/C(=O)Nc1nc2c(s1)CN(CC2)Cc1ccccc1
STL328930
Synonyms: 4-{(1E)-3-{[2-(acetyloxy)ethyl]amino}-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenylacetate
Smiles: CC(=O)OCCNC(=O)/C(=C\c1ccc(cc1)OC(=O)C)/NC(=O)c1ccccc1
STL334107
Synonyms: 4-{(1E)-N-[4-(2-methoxyphenyl)piperazin-1-yl]ethanimidoyl}phenol
Smiles: COc1ccccc1N1CCN(CC1)/N=C(/c1ccc(cc1)O)\C
STL335920
Synonyms: 4-{(1E)-N-[4-(4-methylbenzyl)piperazin-1-yl]ethanimidoyl}phenol
Smiles: Cc1ccc(cc1)CN1CCN(CC1)/N=C(/c1ccc(cc1)O)\C
STL334919
Synonyms: 4-{(1E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]ethanimidoyl}phenol
Smiles: Oc1ccc(cc1)/C(=N/N1CCN(CC1)C1c2ccccc2c2c1cccc2)/C
STL299496
Synonyms: 4-{(1E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]ethanimidoyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)/C(=N/N1CCN(CC1)C1c2ccccc2c2c1cccc2)/C
STL334312
Synonyms: 4-{(1E)-N-[4-(pyridin-2-yl)piperazin-1-yl]propanimidoyl}phenol
Smiles: CC/C(=N\N1CCN(CC1)c1ccccn1)/c1ccc(cc1)O
STL301047
Synonyms: 4-{(1Z)-1-[2-(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)hydrazinylidene]ethyl}phenol
Smiles: CCn1c2ccccc2c2c1nc(N/N=C(\c1ccc(cc1)O)/C)nn2
STL297604
Synonyms: 4-{(1Z)-3-(diethylamino)-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenyl4-methylbenzenesulfonate
Smiles: CCN(C(=O)/C(=C/c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/NC(=O)c1ccccc1)CC
STL298040
Synonyms: 4-{(1Z)-3-(morpholin-4-yl)-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenyl4-methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)/C=C(/C(=O)N1CCOCC1)\NC(=O)c1ccccc1
STL313256
Synonyms: 4-{(1Z)-3-[(3-hydroxypropyl)amino]-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenylacetate
Smiles: OCCCNC(=O)/C(=C/c1ccc(cc1)OC(=O)C)/NC(=O)c1ccccc1
STL334587
Synonyms: 4-{(1Z)-N-[4-(4-chlorobenzyl)piperazin-1-yl]ethanimidoyl}-2-methoxyphenol
Smiles: COc1cc(ccc1O)/C(=N\N1CCN(CC1)Cc1ccc(cc1)Cl)/C
STL334018
Synonyms: 4-{(1Z)-N-[4-(4-chlorobenzyl)piperazin-1-yl]ethanimidoyl}phenol
Smiles: Oc1ccc(cc1)/C(=N\N1CCN(CC1)Cc1ccc(cc1)Cl)/C
STL338036
Synonyms: 4-{(1Z)-N-[4-(4-chlorobenzyl)piperazin-1-yl]ethanimidoyl}phenylacetate
Smiles: C/C(=N/N1CCN(CC1)Cc1ccc(cc1)Cl)/c1ccc(cc1)OC(=O)C
STL335672
Synonyms: 4-{(1Z)-N-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanimidoyl}phenol
Smiles: Oc1ccc(cc1)/C(=N\N1CCN(CC1)Cc1cccc2c1cccc2)/C
STL340835
Synonyms: 4-{(2E)-2-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]hydrazinyl}-N-(4-methoxyphenyl)-4-oxobutanamide
Smiles: COc1ccc(cc1)NC(=O)CCC(=O)N/N=C/c1cn(nc1C)C
STL348442
Synonyms: 4-{(2E)-2-[(2-methyl-1H-indol-3-yl)methylidene]hydrazinyl}-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1[nH]c2c(c1/C=N/Nc1ncnc3c1cnn3c1ccccc1)cccc2
STL357765
Synonyms: 4-{(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl}-1,2,5-oxadiazol-3-amine
Smiles: [O-][N+](=O)c1ccc(o1)/C=N/Nc1nonc1N
STL357764
Synonyms: 4-{(2E)-2-[1-(3,4-dimethoxyphenyl)propylidene]hydrazinyl}-1,2,5-oxadiazol-3-amine
Smiles: CC/C(=N\Nc1nonc1N)/c1ccc(c(c1)OC)OC
STL325082
Synonyms: 4-{(2E)-2-[1-(4-bromophenyl)ethylidene]hydrazinyl}-2-(2,4-dichlorophenyl)quinazoline
Smiles: Brc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl)/C
STL325113
Synonyms: 4-{(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-2-(3,4-dichlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl)/C
STL332542
Synonyms: 4-{(2E)-2-[2-(8-bromo-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)ethylidene]hydrazinyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)N/N=C/Cn1c(Br)nc2c1c(=O)n(C)c(=O)n2C
STL323312
Synonyms: 4-{(2E)-2-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]hydrazinyl}benzenesulfonicacid
Smiles: C=CCN1C(=S)NC(=O)/C(=N\Nc2ccc(cc2)S(=O)(=O)O)/C1=O
STL343438
Synonyms: 4-{(2E)-2-[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]hydrazinyl}benzoicacid
Smiles: OCCN1C(=O)/C(=N/Nc2ccc(cc2)C(=O)O)/C(=C(C1=O)C#N)C
STL304957
Synonyms: 4-{(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-6-methyl-2-phenyl-5-(prop-2-en-1-yl)pyrimidine
Smiles: C=CCc1c(N/N=C(\c2ccc(cc2)Cl)/C)nc(nc1C)c1ccccc1
STL303832
Synonyms: 4-{(2Z)-2-[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]hydrazinyl}benzenesulfonamide
Smiles: OCCN1C(=O)/C(=N\Nc2ccc(cc2)S(=O)(=O)N)/C(=C(C1=O)C#N)C
STL307606
Synonyms: 4-{(4-benzylpiperazin-1-yl)[4-(dimethylamino)phenyl]methyl}-2,6-di-tert-butylphenol
Smiles: CN(c1ccc(cc1)C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)N1CCN(CC1)Cc1ccccc1)C
STL324275
Synonyms: 4-{(5E)-5-[3-(3-carboxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoicacid
Smiles: OC(=O)CCCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCCC(=O)O)/C1=O
STL363938
Synonyms: 4-{(5E)-5-[4-(benzyloxy)-3-methoxybenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoicacid
Smiles: COc1cc(ccc1OCc1ccccc1)/C=C\1/SC(=S)N(C1=O)CCCC(=O)O
STL347744
Synonyms: 4-{(5Z)-5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoicacid
Smiles: OC(=O)CCCN1C(=O)S/C(=C\C=C\c2ccco2)/C1=O
STL307759
Synonyms: 4-{(5Z)-5-[(8-methoxyquinolin-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzoicacid
Smiles: COc1cccc2c1nc(cc2)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)C(=O)O
STL307709
Synonyms: 4-{(5Z)-5-[4-(octyloxy)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}butanoicacid
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=O)N(C1=O)CCCC(=O)O
STL320885
Synonyms: 4-{(E)-2-[4-(dimethylamino)phenyl]ethenyl}-1,2,5-trimethyl-1H-imidazo[4,5-c]pyridin-5-ium
Smiles: C[n+]1ccc2c(c1/C=C/c1ccc(cc1)N(C)C)nc(n2C)C
STL326934
Synonyms: 4-{(E)-2-[4-(dimethylamino)phenyl]ethenyl}-1-ethylpyridinium
Smiles: CC[n+]1ccc(cc1)/C=C/c1ccc(cc1)N(C)C
STL307876
Synonyms: 4-{(E)-2-[5-(2-nitrophenyl)furan-2-yl]ethenyl}pyridine
Smiles: [O-][N+](=O)c1ccccc1c1ccc(o1)/C=C/c1ccncc1
STL327562
Synonyms: 4-{(E)-[(2,4-dimethylquinolin-8-yl)imino]methyl}-2-phenyl-1,3-oxazol-5-ylacetate
Smiles: CC(=O)Oc1oc(nc1/C=N/c1cccc2c1nc(C)cc2C)c1ccccc1
STL325564
Synonyms: 4-{(E)-[(2,6-dimethylquinolin-5-yl)imino]methyl}benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)/C=N/c1c(C)ccc2c1ccc(n2)C
STL325288
Synonyms: 4-{(E)-[(2-hydroxyphenyl)imino]methyl}-2-phenyl-1,3-oxazol-5-ol
Smiles: Oc1oc(nc1/C=N/c1ccccc1O)c1ccccc1
STL328806
Synonyms: 4-{(E)-[(3,4-dihydro-1H-isochromen-1-ylmethyl)imino]methyl}benzene-1,2-diol
Smiles: Oc1ccc(cc1O)/C=N/CC1OCCc2c1cccc2
STL333608
Synonyms: 4-{(E)-[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-2,6-dimethoxyphenylacetate
Smiles: COc1cc(/C=N/n2c(C)nnc2C)cc(c1OC(=O)C)OC
STL299435
Synonyms: 4-{(E)-[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}benzene-1,2-diol
Smiles: Oc1ccc(cc1O)/C=N/n1c(C)nnc1C
STL298436
Synonyms: 4-{(E)-[(4-acetylphenyl)imino]methyl}-3-hydroxy-N-phenylnaphthalene-2-carboxamide
Smiles: O=C(c1cc2ccccc2c(c1O)/C=N/c1ccc(cc1)C(=O)C)Nc1ccccc1
STL299425
Synonyms: 4-{(E)-[(4-benzylpiperazin-1-yl)imino]methyl}-2,6-dimethoxyphenol
Smiles: COc1cc(/C=N/N2CCN(CC2)Cc2ccccc2)cc(c1O)OC
STL333901
Synonyms: 4-{(E)-[(4-benzylpiperazin-1-yl)imino]methyl}-2,6-dimethoxyphenylacetate
Smiles: COc1cc(/C=N/N2CCN(CC2)Cc2ccccc2)cc(c1OC(=O)C)OC
STL335060
Synonyms: 4-{(E)-[(4-benzylpiperazin-1-yl)imino]methyl}-2-ethoxyphenol
Smiles: CCOc1cc(/C=N/N2CCN(CC2)Cc2ccccc2)ccc1O
STL335094
Synonyms: 4-{(E)-[(4-benzylpiperazin-1-yl)imino]methyl}benzene-1,2-diol
Smiles: Oc1ccc(cc1O)/C=N/N1CCN(CC1)Cc1ccccc1
STL335275
Synonyms: 4-{(E)-[(4-benzylpiperazin-1-yl)imino]methyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)/C=N/N1CCN(CC1)Cc1ccccc1
STL334920
Synonyms: 4-{(E)-[(4-benzylpiperazin-1-yl)imino]methyl}phenol
Smiles: Oc1ccc(cc1)/C=N/N1CCN(CC1)Cc1ccccc1
STL360606
Synonyms: 4-{(E)-[(4-chlorophenyl)imino]methyl}-2-(furan-2-yl)-1,3-oxazol-5-yl4-methylbenzoate
Smiles: Cc1ccc(cc1)C(=O)Oc1oc(nc1/C=N/c1ccc(cc1)Cl)c1ccco1
STL360605
Synonyms: 4-{(E)-[(4-chlorophenyl)imino]methyl}-2-phenyl-1,3-oxazol-5-yl2-nitrobenzoate
Smiles: Clc1ccc(cc1)/N=C/c1nc(oc1OC(=O)c1ccccc1[N+](=O)[O-])c1ccccc1
STL327496
Synonyms: 4-{(E)-[(4-iodophenyl)imino]methyl}-2-phenyl-1,3-oxazol-5-ylacetate
Smiles: CC(=O)Oc1oc(nc1/C=N/c1ccc(cc1)I)c1ccccc1
STL333804
Synonyms: 4-{(E)-[(4-iodophenyl)imino]methyl}-2-phenyl-1,3-oxazol-5-ylpropanoate
Smiles: CCC(=O)Oc1oc(nc1/C=N/c1ccc(cc1)I)c1ccccc1
STL360604
Synonyms: 4-{(E)-[(4-methoxyphenyl)imino]methyl}-2-phenyl-1,3-oxazol-5-ylacetate
Smiles: COc1ccc(cc1)/N=C/c1nc(oc1OC(=O)C)c1ccccc1
STL328180
Synonyms: 4-{(E)-[(4-methylphenyl)imino]methyl}-2-phenyl-1,3-oxazol-5-ylpropanoate
Smiles: CCC(=O)Oc1oc(nc1/C=N/c1ccc(cc1)C)c1ccccc1
STL334719
Synonyms: 4-{(E)-[(4-phenylpiperazin-1-yl)imino]methyl}benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)/C=N/N1CCN(CC1)c1ccccc1
STL333301
Synonyms: 4-{(E)-[(4-phenylpiperazin-1-yl)imino]methyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)/C=N/N1CCN(CC1)c1ccccc1
STL333142
Synonyms: 4-{(E)-[(6-bromo-1,3-benzothiazol-2-yl)imino]methyl}benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)/C=N/c1nc2c(s1)cc(cc2)Br
STL332784
Synonyms: 4-{(E)-[(6-ethoxy-1,3-benzothiazol-2-yl)imino]methyl}benzene-1,3-diol
Smiles: CCOc1ccc2c(c1)sc(n2)/N=C/c1ccc(cc1O)O
STL363191
Synonyms: 4-{(E)-[(E)-[2-(1,3-benzothiazol-2-yl)hydrazinylidene](phenyl)methyl]diazenyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)/N=N/C(=N/Nc1nc2c(s1)cccc2)/c1ccccc1
STL320823
Synonyms: 4-{(E)-[(E)-[2-(1-benzyl-1H-benzimidazol-2-yl)hydrazinylidene](phenyl)methyl]diazenyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)/N=N/C(=N/Nc1nc2c(n1Cc1ccccc1)cccc2)/c1ccccc1
STL298482
Synonyms: 4-{(E)-[(E)-[2-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)hydrazinylidene](phenyl)methyl]diazenyl}benzoicacid
Smiles: Cc1nc(N/N=C(\c2ccccc2)/N=N/c2ccc(cc2)C(=O)O)[nH]c(=O)c1
STL322062
Synonyms: 4-{(E)-[2-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)hydrazinylidene]methyl}-N,N-dimethylaniline
Smiles: Cn1nc(c(c1N/N=C/c1ccc(cc1)N(C)C)[N+](=O)[O-])C
STL321335
Synonyms: 4-{(E)-[2-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)hydrazinylidene]methyl}phenol
Smiles: Oc1ccc(cc1)/C=N/Nc1n(C)nc(c1[N+](=O)[O-])C
STL298064
Synonyms: 4-{(E)-[2-(3-methylquinoxalin-2-yl)hydrazinylidene]methyl}phenol
Smiles: Oc1ccc(cc1)/C=N/Nc1nc2ccccc2nc1C
STL357792
Synonyms: 4-{(E)-[2-(4-amino-1,2,5-oxadiazol-3-yl)hydrazinylidene]methyl}benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)/C=N/Nc1nonc1N
STL328723
Synonyms: 4-{(E)-[2-(4-benzylphthalazin-1-yl)hydrazinylidene]methyl}benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)/C=N/Nc1nnc(c2c1cccc2)Cc1ccccc1
STL326472
Synonyms: 4-{(E)-[2-(4-benzylphthalazin-1-yl)hydrazinylidene]methyl}phenol
Smiles: Oc1ccc(cc1)/C=N/Nc1nnc(c2c1cccc2)Cc1ccccc1
STL357363
Synonyms: 4-{(E)-[2-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)hydrazinylidene]methyl}phenol
Smiles: Oc1ccc(cc1)/C=N/Nc1ncnc2c1c1CCCCc1s2
STL327428
Synonyms: 4-{(E)-[2-(5,6-diphenyl-1,2,4-triazin-3-yl)hydrazinylidene]methyl}-2-methoxy-6-nitrophenol
Smiles: COc1cc(/C=N/Nc2nnc(c(n2)c2ccccc2)c2ccccc2)cc(c1O)[N+](=O)[O-]
STL343728
Synonyms: 4-{(E)-[2-(6-bromo-2-methylquinolin-4-yl)hydrazinylidene]methyl}-N,N-dimethylaniline
Smiles: Brc1ccc2c(c1)c(N/N=C/c1ccc(cc1)N(C)C)cc(n2)C
STL301033
Synonyms: 4-{(E)-[2-(8-bromo-5H-[1,2,4]triazino[5,6-b]indol-3-yl)hydrazinylidene]methyl}-N,N-dimethylaniline
Smiles: Brc1ccc2c(c1)c1nnc(nc1[nH]2)N/N=C/c1ccc(cc1)N(C)C
STL321318
Synonyms: 4-{(E)-[2-(phenanthridin-6-yl)hydrazinylidene]methyl}benzene-1,2-diol
Smiles: Oc1cc(/C=N/Nc2nc3ccccc3c3c2cccc3)ccc1O
STL337244
Synonyms: 4-{(E)-[2-(thiophen-2-ylcarbonyl)hydrazinylidene]methyl}benzoicacid
Smiles: O=C(c1cccs1)N/N=C/c1ccc(cc1)C(=O)O
STL362305
Synonyms: 4-{(E)-[2-({[1-(2-chlorobenzyl)-1H-benzimidazol-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: O=C(CSc1nc2c(n1Cc1ccccc1Cl)cccc2)N/N=C/c1ccc(cc1)C(=O)O
STL362328
Synonyms: 4-{(E)-[2-({[1-(4-chlorobenzyl)-1H-benzimidazol-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nc3c(n2Cc2ccc(cc2)Cl)cccc3)ccc1OC(=O)C
STL362331
Synonyms: 4-{(E)-[2-({[1-(4-chlorobenzyl)-1H-benzimidazol-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: O=C(CSc1nc2c(n1Cc1ccc(cc1)Cl)cccc2)N/N=C/c1ccc(cc1)C(=O)O
STL305064
Synonyms: 4-{(E)-[2-({[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)C(=O)O)nc2c(c1=O)c1CCCCc1s2
STL337563
Synonyms: 4-{(E)-[2-({[4,5-bis(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)C(=O)O)nnc1c1ccc(cc1)OC
STL362682
Synonyms: 4-{(E)-[2-({[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2c2ccc(cc2)Cl)c2ccccc2)ccc1OC(=O)C
STL362684
Synonyms: 4-{(E)-[2-({[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1)N/N=C/c1ccc(cc1)C(=O)O
STL334931
Synonyms: 4-{(E)-[2-({[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)C(=O)O)nnc1c1ccc(cc1)C
STL337392
Synonyms: 4-{(E)-[2-({[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2C2CCCCC2)c2ccc(cc2)C)ccc1OC(=O)C
STL362550
Synonyms: 4-{(E)-[2-({[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2,6-dimethoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2CC)c2ccc(cc2)OC)cc(c1OC(=O)C)OC
STL362507
Synonyms: 4-{(E)-[2-({[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2CC)c2ccc(cc2)OC)ccc1OC(=O)C
STL334594
Synonyms: 4-{(E)-[2-({[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: CCn1c(SCC(=O)N/N=C/c2ccc(cc2)C(=O)O)nnc1c1ccc(c(c1)OC)OC
STL362607
Synonyms: 4-{(E)-[2-({[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)Br)N/N=C/c1ccc(cc1)C(=O)O
STL362365
Synonyms: 4-{(E)-[2-({[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl)N/N=C/c1ccc(cc1)C(=O)O
STL362265
Synonyms: 4-{(E)-[2-({[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2c2ccccc2)c2ccc(cc2)Cl)ccc1OC(=O)C
STL362400
Synonyms: 4-{(E)-[2-({[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)N/N=C/c1ccc(cc1)C(=O)O
STL333199
Synonyms: 4-{(E)-[2-({[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(s2)SCc2ccccc2)ccc1OC(=O)C
STL308042
Synonyms: 4-{(E)-[2-({[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoicacid
Smiles: O=C(N/N=C/c1ccc(cc1)C(=O)O)CSc1nnc(s1)SCc1ccccc1
STL349552
Synonyms: 4-{(E)-[2-hydroxy-3-methyl-2-(1H-1,2,4-triazol-1-ylmethyl)cyclohexylidene]methyl}benzaldehyde
Smiles: O=Cc1ccc(cc1)/C=C/1\CCCC(C1(O)Cn1ncnc1)C
STL296468
Synonyms: 4-{(E)-[4-(methoxycarbonyl)-5-methyl-3-oxo-1,3-dihydro-2H-pyrrol-2-ylidene]methyl}benzoicacid
Smiles: COC(=O)C1=C(C)N/C(=C/c2ccc(cc2)C(=O)O)/C1=O
STL303035
Synonyms: 4-{(E)-[5-imino-7-oxo-2-(pentan-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenylfuran-2-carboxylate
Smiles: CCC(c1nn2c(=NC(=O)/C(=C/c3ccc(cc3)OC(=O)c3ccco3)/C2=N)s1)CC
STL363741
Synonyms: 4-{(Z)-[1-(4-ethoxyphenyl)-4-(methoxycarbonyl)-5-methyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]methyl}benzoicacid
Smiles: CCOc1ccc(cc1)N1C(=O)/C(=C\c2ccc(cc2)C(=O)O)/C(=C1C)C(=O)OC
STL335075
Synonyms: 4-{(Z)-[2,4,6-trioxo-1-(2,4,6-trimethylphenyl)tetrahydropyrimidin-5(2H)-ylidene]methyl}benzoicacid
Smiles: Cc1cc(C)c(c(c1)C)N1C(=O)NC(=O)/C(=C/c2ccc(cc2)C(=O)O)/C1=O
STL302351
Synonyms: 4-{(Z)-[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl3-nitrobenzoate
Smiles: O=C1OC(=N/C/1=C\c1ccc(cc1)OC(=O)c1cccc(c1)[N+](=O)[O-])c1ccccc1Cl
STL340582
Synonyms: 4-{(Z)-[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)/C=C/1\N=C(OC1=O)c1ccccc1Cl
STL356500
Synonyms: 4-{(Z)-[2-(2-fluorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl4-methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1ccc(cc1)/C=C/1\N=C(OC1=O)c1ccccc1F
STL301065
Synonyms: 4-{(Z)-[2-(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)hydrazinylidene]methyl}benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)/C=N\Nc1nnc2c(n1)n(Cc1ccccc1)c1c2cccc1
STL301052
Synonyms: 4-{(Z)-[2-(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)hydrazinylidene]methyl}phenol
Smiles: Oc1ccc(cc1)/C=N\Nc1nnc2c(n1)n(C)c1c2cc(cc1)Br
STL338384
Synonyms: 4-{10-methyl-6-[(3-methylphenyl)amino]-8-(pyridin-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzene-1,2-diol
Smiles: Cc1cccc(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(c(c1)O)O)C)c1ccccn1
STL338339
Synonyms: 4-{10-methyl-6-[(4-methylphenyl)amino]-8-(pyridin-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzene-1,2-diol
Smiles: Cc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(c(c1)O)O)C)c1ccccn1
STL330096
Synonyms: 4-{2,5-dimethyl-3-[(E)-(2-{[3-(trifluoromethyl)phenyl]acetyl}hydrazinylidene)methyl]-1H-pyrrol-1-yl}-3-methylbenzoicacid
Smiles: O=C(Cc1cccc(c1)C(F)(F)F)N/N=C/c1cc(n(c1C)c1ccc(cc1C)C(=O)O)C
STL363598
Synonyms: 4-{2,5-dimethyl-3-[(Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]-1H-pyrrol-1-yl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=NN(C1=O)c1ccccc1)C
STL333577
Synonyms: 4-{2-(2-fluorophenyl)-4-hydroxy-3-[(4-methylphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1F)c1c(C)n(n(c1=O)c1ccccc1)C
STL336888
Synonyms: 4-{2-nitro-4-[(trifluoromethyl)sulfonyl]phenyl}morpholine
Smiles: [O-][N+](=O)c1cc(ccc1N1CCOCC1)S(=O)(=O)C(F)(F)F
STL328656
Synonyms: 4-{2-[(2-methylundecan-2-yl)sulfanyl]ethyl}pyridine
Smiles: CCCCCCCCCC(SCCc1ccncc1)(C)C
STL296541
Synonyms: 4-{2-[(2E)-2-(3,4-dimethoxybenzylidene)hydrazinyl]-5-fluoropyrimidin-4-yl}morpholine
Smiles: COc1cc(/C=N/Nc2ncc(c(n2)N2CCOCC2)F)ccc1OC
STL308438
Synonyms: 4-{2-[(3,5-di-tert-butyl-4-fluorophenyl)sulfanyl]ethyl}pyridine
Smiles: CC(c1cc(SCCc2ccncc2)cc(c1F)C(C)(C)C)(C)C
STL308443
Synonyms: 4-{2-[(3,5-di-tert-butylphenyl)sulfanyl]ethyl}pyridine
Smiles: CC(c1cc(SCCc2ccncc2)cc(c1)C(C)(C)C)(C)C
STL327351
Synonyms: 4-{2-[(4-tert-butyl-2,6-dimethylphenyl)sulfanyl]ethyl}-1-[2-(4-nitrophenyl)-2-oxoethyl]pyridinium
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])C[n+]1ccc(cc1)CCSc1c(C)cc(cc1C)C(C)(C)C
STL357524
Synonyms: 4-{2-[(cyclohexylcarbamoyl)amino]ethyl}benzenesulfonamide
Smiles: O=C(NC1CCCCC1)NCCc1ccc(cc1)S(=O)(=O)N
STL304965
Synonyms: 4-{2-[(E)-2-(2-hydroxynaphthalen-1-yl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoicacid
Smiles: Oc1ccc2c(c1/C=C/c1nc3ccccc3c(=O)n1c1ccc(cc1)C(=O)O)cccc2
STL329712
Synonyms: 4-{2-[({2-[3-(prop-1-en-2-yl)phenyl]propan-2-yl}carbamoyl)amino]ethyl}benzenesulfonamide
Smiles: O=C(NC(c1cccc(c1)C(=C)C)(C)C)NCCc1ccc(cc1)S(=O)(=O)N
STL330950
Synonyms: 4-{3-(3,4-dimethoxyphenyl)-1-[(4-methylphenyl)sulfonyl]-4,5-dihydro-1H-pyrazol-5-yl}-N,N-dimethylaniline
Smiles: COc1ccc(cc1OC)C1=NN(C(C1)c1ccc(cc1)N(C)C)S(=O)(=O)c1ccc(cc1)C
STL332009
Synonyms: 4-{3-(4-chlorophenyl)-5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-1-yl}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)N(C)C)c1ccc(cc1)Cl
STL325524
Synonyms: 4-{3-(benzyloxy)-2-[(3-phenylpropanoyl)oxy]propyl}-4-methylmorpholin-4-ium
Smiles: O=C(OC(C[N+]1(C)CCOCC1)COCc1ccccc1)CCc1ccccc1
STL326545
Synonyms: 4-{3-(benzyloxy)-2-[(phenylacetyl)oxy]propyl}-4-methylmorpholin-4-ium
Smiles: O=C(OC(C[N+]1(C)CCOCC1)COCc1ccccc1)Cc1ccccc1
STL310053
Synonyms: 4-{3-hydroxy-4-[1-(2-methylpropyl)-1H-benzimidazol-2-yl]-1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridin-6-yl}benzene-1,2,3-triol
Smiles: CC(Cn1c2ccccc2nc1c1cc(nc2c1c(O)nn2C(C)C)c1ccc(c(c1O)O)O)C
STL316465
Synonyms: 4-{3-methoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-6-methyl-1-(propan-2-yl)-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridine-3,7-diol
Smiles: COc1cc(ccc1OCC(=C)C)c1c2oc3c(c2nc2c1c(O)nn2C(C)C)ccc(c3C)O
STL363627
Synonyms: 4-{3-[(1E)-2-cyano-3-oxo-3-(phenylamino)prop-1-en-1-yl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoicacid
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)C(=O)O)C)/C(=O)Nc1ccccc1
STL351721
Synonyms: 4-{3-[(3-chlorobenzyl)oxy]phenyl}-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: Clc1cccc(c1)COc1cccc(c1)C1CC(=Nc2c1c[nH]n2)O
STL302343
Synonyms: 4-{3-[(E)-{2-[(3-bromophenoxy)acetyl]hydrazinylidene}methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-3-methylbenzoicacid
Smiles: O=C(COc1cccc(c1)Br)N/N=C/c1cc(n(c1C)c1ccc(cc1C)C(=O)O)C
STL363614
Synonyms: 4-{3-[(Z)-2-(4-bromophenyl)-2-cyanoethenyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoicacid
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)C(=O)O)C)/c1ccc(cc1)Br
STL315813
Synonyms: 4-{3-[1-(2-methoxyethyl)-1H-indol-3-yl]propanoyl}-N,N-dimethylpiperazine-1-sulfonamide
Smiles: COCCn1cc(c2c1cccc2)CCC(=O)N1CCN(CC1)S(=O)(=O)N(C)C
STL335228
Synonyms: 4-{4,5-bis[(cyclohexylamino)methyl]-1H-1,2,3-triazol-1-yl}-1,2,5-oxadiazol-3-amine
Smiles: Nc1nonc1n1nnc(c1CNC1CCCCC1)CNC1CCCCC1
STL341580
Synonyms: 4-{4-(4-bromophenyl)-5-[(1,3-dioxolan-2-ylmethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Brc1ccc(cc1)n1c(SCC2OCCO2)nnc1c1ccncc1
STL308090
Synonyms: 4-{4-(4-bromophenyl)-5-[(3-methoxybenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: COc1cccc(c1)CSc1nnc(n1c1ccc(cc1)Br)c1ccncc1
STL340584
Synonyms: 4-{4-(4-bromophenyl)-5-[(4-methoxybenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: COc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)Br)c1ccncc1
STL337302
Synonyms: 4-{4-(4-chlorophenyl)-5-[(2,5-dimethylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Clc1ccc(cc1)n1c(nnc1c1ccncc1)SCc1cc(C)ccc1C
STL338809
Synonyms: 4-{4-(4-chlorophenyl)-5-[(2,6-difluorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Clc1ccc(cc1)n1c(nnc1c1ccncc1)SCc1c(F)cccc1F
STL299406
Synonyms: 4-{4-(4-chlorophenyl)-5-[(4-methoxybenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: COc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1
STL358090
Synonyms: 4-{4-ethyl-5-[(2-fluorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CCn1c(SCc2ccccc2F)nnc1c1ccncc1
STL339693
Synonyms: 4-{4-ethyl-5-[(2-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CCn1c(SCc2ccccc2C)nnc1c1ccncc1
STL358091
Synonyms: 4-{4-ethyl-5-[(3-fluorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CCn1c(SCc2cccc(c2)F)nnc1c1ccncc1
STL358086
Synonyms: 4-{4-ethyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CCn1c(SCc2cccc(c2)C)nnc1c1ccncc1
STL352349
Synonyms: 4-{4-ethyl-5-[(4-fluorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}aniline
Smiles: CCn1c(SCc2ccc(cc2)F)nnc1c1ccc(cc1)N
STL358087
Synonyms: 4-{4-ethyl-5-[(4-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CCn1c(SCc2ccc(cc2)C)nnc1c1ccncc1
STL298707
Synonyms: 4-{4-methyl-5-[(2-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cc1ccccc1CSc1nnc(n1C)c1ccncc1
STL358046
Synonyms: 4-{4-methyl-5-[(4-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cc1ccc(cc1)CSc1nnc(n1C)c1ccncc1
STL358047
Synonyms: 4-{4-methyl-5-[(naphthalen-1-ylmethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cn1c(SCc2cccc3c2cccc3)nnc1c1ccncc1
STL336153
Synonyms: 4-{4-methyl-6-[2-(morpholin-4-yl)ethoxy]-5-nitropyrimidin-2-yl}morpholine
Smiles: [O-][N+](=O)c1c(OCCN2CCOCC2)nc(nc1C)N1CCOCC1
STL322128
Synonyms: 4-{4-[(1E)-3,3-dimethyltriaz-1-en-1-yl]phenyl}-1H-imidazole
Smiles: CN(/N=N/c1ccc(cc1)c1nc[nH]c1)C
STL326764
Synonyms: 4-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: c1ccc(cc1)/C=C/CN1CCN(CC1)c1ncnc2c1c1CCCCc1s2
STL343596
Synonyms: 4-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}[1]benzofuro[3,2-d]pyrimidine
Smiles: c1ccc(cc1)/C=C/CN1CCN(CC1)c1ncnc2c1oc1c2cccc1
STL312717
Synonyms: 4-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxyphenyl}-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: COc1cc(ccc1OCc1c(C)noc1C)C1SCC(=Nc2c1cn[nH]2)O
STL310216
Synonyms: 4-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl}-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2[nH]ncc2C(SC1)c1ccc(cc1)OCc1c(C)noc1C
STL350988
Synonyms: 4-{4-[(3-phenyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)oxy]phenyl}butan-2-one
Smiles: CC(=O)CCc1ccc(cc1)Oc1ccc2n(n1)c(nn2)c1ccccc1
STL317172
Synonyms: 4-{4-[(4,6-dimethylpyrimidin-2-yl)amino]butanoyl}-N,N-dimethylpiperazine-1-sulfonamide
Smiles: O=C(N1CCN(CC1)S(=O)(=O)N(C)C)CCCNc1nc(C)cc(n1)C
STL364085
Synonyms: 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one
Smiles: O=C(c1ccc(cc1)c1nn(C)c(=O)c2c1cccc2)N1CCN(CC1)Cc1ccccc1
STL364086
Synonyms: 4-{4-[(4-benzylpiperidin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one
Smiles: O=C(c1ccc(cc1)c1nn(C)c(=O)c2c1cccc2)N1CCC(CC1)Cc1ccccc1
STL364119
Synonyms: 4-{4-[(4-carbamoylphenyl)amino]phthalazin-1-yl}benzamide
Smiles: NC(=O)c1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(cc1)C(=O)N
STL342411
Synonyms: 4-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
Smiles: COc1cc2c(cc1OC)[nH]c1c2ncnc1N1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1
STL345436
Synonyms: 4-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-8-fluoro-5H-pyrimido[5,4-b]indole
Smiles: Clc1ccc(cc1)C(c1ccccc1)N1CCN(CC1)c1ncnc2c1[nH]c1c2cc(cc1)F
STL345980
Synonyms: 4-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-9-methyl-5H-pyrimido[5,4-b]indole
Smiles: Clc1ccc(cc1)C(c1ccccc1)N1CCN(CC1)c1ncnc2c1[nH]c1c2c(C)ccc1
STL309049
Synonyms: 4-{4-[(4-ethylpiperazin-1-yl)methyl]-7-methylfuro[2,3-c]pyridin-2-yl}-6,7-dimethyl-2H-chromen-2-one
Smiles: CCN1CCN(CC1)Cc1cnc(c2c1cc(o2)c1cc(=O)oc2c1cc(C)c(c2)C)C
STL319946
Synonyms: 4-{4-[(4-fluorophenyl)sulfonyl]piperazin-1-yl}-N-(1H-imidazol-2-yl)-4-oxobutanamide
Smiles: O=C(Nc1ncc[nH]1)CCC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)F
STL319064
Synonyms: 4-{4-[(4-fluorophenyl)sulfonyl]piperazin-1-yl}-N-(1H-indol-4-yl)-4-oxobutanamide
Smiles: O=C(Nc1cccc2c1cc[nH]2)CCC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)F
STL320053
Synonyms: 4-{4-[(benzylamino)methyl]-7-methylfuro[2,3-c]pyridin-2-yl}-6,7-dimethyl-2H-chromen-2-one
Smiles: O=c1oc2cc(C)c(cc2c(c1)c1oc2c(c1)c(CNCc1ccccc1)cnc2C)C
STL313752
Synonyms: 4-{4-[(benzylamino)methyl]-7-methylfuro[2,3-c]pyridin-2-yl}-7,8-dimethyl-2H-chromen-2-one
Smiles: O=c1cc(c2oc3c(c2)c(CNCc2ccccc2)cnc3C)c2c(o1)c(C)c(cc2)C
STL311903
Synonyms: 4-{4-[(benzylamino)methyl]-7-methylfuro[2,3-c]pyridin-2-yl}-7-methyl-2H-chromen-2-one
Smiles: Cc1ccc2c(c1)oc(=O)cc2c1oc2c(c1)c(CNCc1ccccc1)cnc2C
STL313154
Synonyms: 4-{4-[(cyclohexylamino)methyl]-7-methylfuro[2,3-c]pyridin-2-yl}-7,8-dimethyl-2H-chromen-2-one
Smiles: O=c1cc(c2cc3c(o2)c(C)ncc3CNC2CCCCC2)c2c(o1)c(C)c(cc2)C
STL314861
Synonyms: 4-{4-[(cyclohexylamino)methyl]-7-methylfuro[2,3-c]pyridin-2-yl}-7-methyl-2H-chromen-2-one
Smiles: Cc1ccc2c(c1)oc(=O)cc2c1cc2c(o1)c(C)ncc2CNC1CCCCC1
STL315538
Synonyms: 4-{4-[(cyclopentylamino)methyl]-7-methylfuro[2,3-c]pyridin-2-yl}-7,8-dimethyl-2H-chromen-2-one
Smiles: O=c1cc(c2cc3c(o2)c(C)ncc3CNC2CCCC2)c2c(o1)c(C)c(cc2)C
STL310526
Synonyms: 4-{4-[(ethylamino)methyl]-7-methylfuro[2,3-c]pyridin-2-yl}-7-methyl-2H-chromen-2-one
Smiles: CCNCc1cnc(c2c1cc(o2)c1cc(=O)oc2c1ccc(c2)C)C
STL317006
Synonyms: 4-{4-[1-(2-methoxyethyl)-1H-indol-3-yl]butanoyl}-N,N-dimethylpiperazine-1-sulfonamide
Smiles: COCCn1cc(c2c1cccc2)CCCC(=O)N1CCN(CC1)S(=O)(=O)N(C)C
STL318296
Synonyms: 4-{4-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethoxy]phenyl}-1-(propan-2-yl)-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridine-3,6,7-triol
Smiles: Cc1cc(n(n1)CCOc1ccc(cc1)c1c2c(O)nn(c2nc2c1oc1c2ccc(c1O)O)C(C)C)C
STL364079
Synonyms: 4-{4-[2-(4-benzylpiperidin-1-yl)-2-oxoethoxy]phenyl}-2-methylphthalazin-1(2H)-one
Smiles: O=C(N1CCC(CC1)Cc1ccccc1)COc1ccc(cc1)c1nn(C)c(=O)c2c1cccc2
STL338485
Synonyms: 4-{4-[2-(benzyloxy)ethoxy]-4-methylpent-2-yn-1-yl}morpholine
Smiles: CC(C#CCN1CCOCC1)(OCCOCc1ccccc1)C
STL298247
Synonyms: 4-{4-[3-methyl-2,6-dioxo-7-(2-phenylethyl)-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazin-1-yl}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1CCN(CC1)c1nc2c(n1CCc1ccccc1)c(=O)[nH]c(=O)n2C
STL323679
Synonyms: 4-{4-[4-(dimethylamino)phenyl]pyridinium-1-yl}-2-oxo-5-{(E)-[2-(pyridin-4-ylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: CN(c1ccc(cc1)c1cc[n+](cc1)c1[n-]c(=O)sc1/C=N/NC(=O)c1ccncc1)C
STL297881
Synonyms: 4-{4-[4-(dimethylamino)phenyl]pyridinium-1-yl}-5-formyl-1,3-thiazol-2-olate
Smiles: O=Cc1sc(nc1[n+]1ccc(cc1)c1ccc(cc1)N(C)C)[O-]
STL324640
Synonyms: 4-{4-[4-(dimethylamino)phenyl]pyridinium-1-yl}-5-[(E)-{2-[(2-hydroxyphenyl)carbonyl]hydrazinylidene}methyl]-2-oxo-1,3-thiazol-3-ide
Smiles: O=c1sc(c([n-]1)[n+]1ccc(cc1)c1ccc(cc1)N(C)C)/C=N/NC(=O)c1ccccc1O
STL327476
Synonyms: 4-{5,6-dimethoxy-3-methyl-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one
Smiles: COc1cc2c(cc1OC)c(c(n2S(=O)(=O)c1ccc(cc1)C)CCC(=O)C)C
STL334555
Synonyms: 4-{5-[(1E)-1-hydrazinylideneethyl]-2-propoxybenzyl}morpholine
Smiles: CCCOc1ccc(cc1CN1CCOCC1)/C(=N/N)/C
STL358050
Synonyms: 4-{5-[(2,4-dichlorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Clc1ccc(c(c1)Cl)CSc1nnc(n1C)c1ccncc1
STL342162
Synonyms: 4-{5-[(2,5-dimethylbenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: C=CCn1c(nnc1c1ccncc1)SCc1cc(C)ccc1C
STL339293
Synonyms: 4-{5-[(2,6-dichlorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cn1c(nnc1c1ccncc1)SCc1c(Cl)cccc1Cl
STL340504
Synonyms: 4-{5-[(2,6-difluorobenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cc1ccc(cc1)n1c(nnc1c1ccncc1)SCc1c(F)cccc1F
STL340997
Synonyms: 4-{5-[(2,6-difluorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Fc1cccc(c1CSc1nnc(n1Cc1ccco1)c1ccncc1)F
STL362839
Synonyms: 4-{5-[(2-bromo-4-ethylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine
Smiles: CCc1ccc(c(c1)Br)OCc1onc(n1)c1ccncc1
STL336013
Synonyms: 4-{5-[(2-bromobenzyl)sulfanyl]-1H-tetrazol-1-yl}benzoicacid
Smiles: Brc1ccccc1CSc1nnnn1c1ccc(cc1)C(=O)O
STL358048
Synonyms: 4-{5-[(2-chlorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Clc1ccccc1CSc1nnc(n1C)c1ccncc1
STL351529
Synonyms: 4-{5-[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-3-yl)sulfanyl]-1H-tetrazol-1-yl}benzoicacid
Smiles: O=C1Nc2ccccc2CCC1Sc1nnnn1c1ccc(cc1)C(=O)O
STL358051
Synonyms: 4-{5-[(3,4-dichlorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cn1c(SCc2ccc(c(c2)Cl)Cl)nnc1c1ccncc1
STL336131
Synonyms: 4-{5-[(3-bromobenzyl)sulfanyl]-1H-tetrazol-1-yl}benzoicacid
Smiles: Brc1cccc(c1)CSc1nnnn1c1ccc(cc1)C(=O)O
STL340366
Synonyms: 4-{5-[(3-bromobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CCn1c(SCc2cccc(c2)Br)nnc1c1ccncc1
STL339497
Synonyms: 4-{5-[(3-chlorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Clc1cccc(c1)CSc1nnc(n1Cc1ccco1)c1ccncc1
STL364046
Synonyms: 4-{5-[(3-chlorobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: C=CCn1c(SCc2cccc(c2)Cl)nnc1c1ccncc1
STL358088
Synonyms: 4-{5-[(3-chlorobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CCn1c(SCc2cccc(c2)Cl)nnc1c1ccncc1
STL358049
Synonyms: 4-{5-[(3-chlorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Clc1cccc(c1)CSc1nnc(n1C)c1ccncc1
STL339869
Synonyms: 4-{5-[(3-fluorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Fc1cccc(c1)CSc1nnc(n1Cc1ccco1)c1ccncc1
STL340768
Synonyms: 4-{5-[(4-bromobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Brc1ccc(cc1)CSc1nnc(n1Cc1ccco1)c1ccncc1
STL336171
Synonyms: 4-{5-[(4-fluorobenzyl)sulfanyl]-1H-tetrazol-1-yl}benzamide
Smiles: Fc1ccc(cc1)CSc1nnnn1c1ccc(cc1)C(=O)N
STL341796
Synonyms: 4-{5-[(4-fluorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Fc1ccc(cc1)CSc1nnc(n1Cc1ccco1)c1ccncc1
STL358053
Synonyms: 4-{5-[(4-fluorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Fc1ccc(cc1)CSc1nnc(n1C)c1ccncc1
STL336493
Synonyms: 4-{5-[(4-methoxy-3-nitrobenzyl)sulfanyl]-1H-tetrazol-1-yl}benzamide
Smiles: COc1ccc(cc1[N+](=O)[O-])CSc1nnnn1c1ccc(cc1)C(=O)N
STL339274
Synonyms: 4-{5-[(4-methoxybenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: COc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)C)c1ccncc1
STL339690
Synonyms: 4-{5-[(4-tert-butylbenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: C=CCn1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1ccncc1
STL347717
Synonyms: 4-{5-[(4-tert-butylbenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CCn1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1ccncc1
STL348249
Synonyms: 4-{5-[(4-tert-butylbenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CC(c1ccc(cc1)CSc1nnc(n1C)c1ccncc1)(C)C
STL354095
Synonyms: 4-{5-[(E)-(3-ethyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoicacid
Smiles: CCN1C(=O)S/C(=C/c2ccc(o2)c2ccc(cc2)C(=O)O)/C1=O
STL320992
Synonyms: 4-{5-[(E)-2-carboxy-2-cyanoethenyl]furan-2-yl}benzoicacid
Smiles: N#C/C(=C\c1ccc(o1)c1ccc(cc1)C(=O)O)/C(=O)O
STL347634
Synonyms: 4-{5-[(E)-{2-[(4-amino-1,2,5-oxadiazol-3-yl)carbonyl]hydrazinylidene}methyl]furan-2-yl}benzenesulfonamide
Smiles: O=C(c1nonc1N)N/N=C/c1ccc(o1)c1ccc(cc1)S(=O)(=O)N
STL317082
Synonyms: 4-{5-[1-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)-3-methoxy-3-oxopropyl]furan-2-yl}benzoicacid
Smiles: COC(=O)CC(c1c(C)[nH]nc1O)c1ccc(o1)c1ccc(cc1)C(=O)O
STL324577
Synonyms: 4-{6-chloro-2-(methylsulfanyl)-5-[4-(propan-2-yloxy)benzyl]pyrimidin-4-yl}morpholine
Smiles: CSc1nc(Cl)c(c(n1)N1CCOCC1)Cc1ccc(cc1)OC(C)C
STL337096
Synonyms: 4-{6-[(2E)-2-(2-nitrobenzylidene)hydrazinyl]pyrimidin-4-yl}morpholine
Smiles: [O-][N+](=O)c1ccccc1/C=N/Nc1ncnc(c1)N1CCOCC1
STL336832
Synonyms: 4-{6-[(2E)-2-(3-fluorobenzylidene)hydrazinyl]pyrimidin-4-yl}morpholine
Smiles: Fc1cccc(c1)/C=N/Nc1ncnc(c1)N1CCOCC1
STL338162
Synonyms: 4-{6-[(3,4-dimethylphenyl)amino]-10-methyl-8-(pyridin-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzene-1,2-diol
Smiles: Cc1nn(c2c1C(c1ccc(c(c1)O)O)n1c(=N2)c(Nc2ccc(c(c2)C)C)nc2c1cccc2)c1ccccn1
STL337354
Synonyms: 4-{6-[(3,4-dimethylphenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzene-1,2-diol
Smiles: Cc1nn(c2c1C(c1ccc(c(c1)O)O)n1c(=N2)c(Nc2ccc(c(c2)C)C)nc2c1cccc2)c1ccccc1
STL347190
Synonyms: 4-{8-[(4-methoxyphenyl)carbamoyl]-9,11-dioxo-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-10(11H)-yl}phenylacetate
Smiles: COc1ccc(cc1)NC(=O)C1N2C=Cc3c(C2C2C1C(=O)N(C2=O)c1ccc(cc1)OC(=O)C)cccc3
STL324673
Synonyms: 4-{benzyl[2-(dimethylamino)ethyl]amino}-2-(dimethylamino)pyridine-3-carbonitrile
Smiles: N#Cc1c(ccnc1N(C)C)N(Cc1ccccc1)CCN(C)C
STL329664
Synonyms: 4-{[(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)carbamoyl]amino}-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)C)Nc1ccc(cc1)S(=O)(=O)Nc1noc(c1)C
STL330514
Synonyms: 4-{[(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)carbamoyl]amino}butanoicacid
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)C)NCCCC(=O)O
STL332758
Synonyms: 4-{[(1,1-dioxidotetrahydrothiophen-3-yl)amino]methyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)CNC1CCS(=O)(=O)C1
STL336592
Synonyms: 4-{[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]methyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)CSc1nc2c(n1C)c(=O)n(c(=O)n2C)C
STL315718
Synonyms: 4-{[(1,6-dimethyl-4-oxo-1,4-dihydropyridin-3-yl)oxy]acetyl}-N,N-dimethylpiperazine-1-sulfonamide
Smiles: O=C(N1CCN(CC1)S(=O)(=O)N(C)C)COc1cn(C)c(cc1=O)C
STL348796
Synonyms: 4-{[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]methyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)CSc1ncnc2c1cnn2Cc1ccccc1
STL349306
Synonyms: 4-{[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]methyl}benzonitrile
Smiles: N#Cc1ccc(cc1)CSc1ncnc2c1cnn2Cc1ccccc1
STL356594
Synonyms: 4-{[(1-ethyl-2,5-dioxopyrrolidin-3-yl)amino]methyl}benzenesulfonamide
Smiles: CCN1C(=O)CC(C1=O)NCc1ccc(cc1)S(=O)(=O)N
STL356572
Synonyms: 4-{[(1-methyl-2,5-dioxopyrrolidin-3-yl)amino]methyl}benzenesulfonamide
Smiles: O=C1CC(C(=O)N1C)NCc1ccc(cc1)S(=O)(=O)N
STL341007
Synonyms: 4-{[(1-phenylcyclopentyl)carbonyl]amino}-N-(tetrahydrofuran-2-ylmethyl)benzamide
Smiles: O=C(c1ccc(cc1)NC(=O)C1(CCCC1)c1ccccc1)NCC1CCCO1
STL298318
Synonyms: 4-{[(1E)-3-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide
Smiles: COc1ccc(cc1OC)C(=O)/C=C/Nc1ccc(cc1)S(=O)(=O)N
STL352637
Synonyms: 4-{[(1E)-3-(naphthalen-1-yl)-3-oxoprop-1-en-1-yl]amino}-N-(pyrimidin-2-yl)benzenesulfonamide
Smiles: O=C(c1cccc2c1cccc2)/C=C/Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
STL352636
Synonyms: 4-{[(1E)-3-oxo-3-phenylprop-1-en-1-yl]amino}-N-(pyrimidin-2-yl)benzenesulfonamide
Smiles: O=C(c1ccccc1)/C=C/Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
STL348380
Synonyms: 4-{[(1E)-8-methoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]amino}phenol
Smiles: COc1ccc2c(c1)c1/c(=N\c3ccc(cc3)O)/ssc1C(N2)(C)C
STL308101
Synonyms: 4-{[(1E,2E)-3-phenylprop-2-en-1-ylidene]amino}-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/C=C/c1ccccc1)c1cccnc1
STL308100
Synonyms: 4-{[(1E,2E)-3-phenylprop-2-en-1-ylidene]amino}-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/C=C/c1ccccc1)c1ccncc1
STL336824
Synonyms: 4-{[(1E,2Z)-2-chloro-3-(4-nitrophenyl)prop-2-en-1-ylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: Cl/C(=C\c1ccc(cc1)[N+](=O)[O-])/C=N/c1c(C)n(n(c1=O)c1ccccc1)C
STL336521
Synonyms: 4-{[(1Z)-3-amino-2-cyano-3-oxoprop-1-en-1-yl]amino}butanoicacid
Smiles: N#C/C(=C/NCCCC(=O)O)/C(=O)N
STL351602
Synonyms: 4-{[(2,4-dimethyl-1,3-thiazol-5-yl)carbonyl]amino}butanoicacid
Smiles: Cc1nc(sc1C(=O)NCCCC(=O)O)C
STL363258
Synonyms: 4-{[(2,5-dichlorophenyl)sulfonyl]amino}benzoicacid
Smiles: Clc1ccc(c(c1)S(=O)(=O)Nc1ccc(cc1)C(=O)O)Cl
STL330046
Synonyms: 4-{[(2,5-dioxopyrrolidin-1-yl)methyl]amino}benzoicacid
Smiles: O=C1CCC(=O)N1CNc1ccc(cc1)C(=O)O
STL307029
Synonyms: 4-{[(2,6-dichlorophenyl)sulfonyl]amino}butanoicacid
Smiles: OC(=O)CCCNS(=O)(=O)c1c(Cl)cccc1Cl
STL296713
Synonyms: 4-{[(2,6-dimethoxyphenyl)carbonyl]amino}benzoicacid
Smiles: COc1cccc(c1C(=O)Nc1ccc(cc1)C(=O)O)OC
STL311142
Synonyms: 4-{[(2-hydroxy-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)acetyl]amino}benzamide
Smiles: O=C(CN1C(=NC2(C1=O)CCCC2)O)Nc1ccc(cc1)C(=O)N
STL302884
Synonyms: 4-{[(2-imino-4-oxo-1,3-thiazolidin-5-yl)acetyl]amino}butanoicacid
Smiles: O=C(CC1SC(=N)NC1=O)NCCCC(=O)O
STL328209
Synonyms: 4-{[(2-methoxyphenyl)carbamoyl]amino}benzoicacid
Smiles: COc1ccccc1NC(=O)Nc1ccc(cc1)C(=O)O
STL327990
Synonyms: 4-{[(2-methoxyquinolin-4-yl)carbonyl]amino}benzoicacid
Smiles: COc1nc2ccccc2c(c1)C(=O)Nc1ccc(cc1)C(=O)O
STL308450
Synonyms: 4-{[(2-nitrophenyl)sulfanyl]amino}cyclohexanecarboxylicacid
Smiles: OC(=O)C1CCC(CC1)NSc1ccccc1[N+](=O)[O-]
STL304780
Synonyms: 4-{[(2E)-2-[(furan-2-ylcarbonyl)amino]-3-(3-nitrophenyl)prop-2-enoyl]amino}butanoicacid
Smiles: OC(=O)CCCNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccco1
STL304803
Synonyms: 4-{[(2E)-2-[(furan-2-ylcarbonyl)amino]-3-(4-nitrophenyl)prop-2-enoyl]amino}butanoicacid
Smiles: OC(=O)CCCNC(=O)/C(=C\c1ccc(cc1)[N+](=O)[O-])/NC(=O)c1ccco1
STL304827
Synonyms: 4-{[(2E)-2-{[(4-bromophenyl)carbonyl]amino}-3-phenylprop-2-enoyl]amino}butanoicacid
Smiles: OC(=O)CCCNC(=O)/C(=C\c1ccccc1)/NC(=O)c1ccc(cc1)Br
STL297767
Synonyms: 4-{[(2E)-2-{[(5-bromofuran-2-yl)carbonyl]amino}-3-(3-nitrophenyl)prop-2-enoyl]amino}butanoicacid
Smiles: OC(=O)CCCNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccc(o1)Br
STL297747
Synonyms: 4-{[(2E)-2-{[(5-bromofuran-2-yl)carbonyl]amino}-3-(4-bromophenyl)prop-2-enoyl]amino}butanoicacid
Smiles: OC(=O)CCCNC(=O)/C(=C\c1ccc(cc1)Br)/NC(=O)c1ccc(o1)Br
STL297921
Synonyms: 4-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-{[(5-bromofuran-2-yl)carbonyl]amino}prop-2-enoyl]amino}butanoicacid
Smiles: OC(=O)CCCNC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccc(o1)Br
STL334728
Synonyms: 4-{[(2E)-3-chlorobut-2-en-1-yl]oxy}-2,8-dimethylquinoline
Smiles: C/C(=C\COc1cc(C)nc2c1cccc2C)/Cl
STL339151
Synonyms: 4-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: c1ccc(cc1)/C=C/CSc1ncnc2c1c1CCCCc1s2
STL317661
Synonyms: 4-{[(2E)-4,6-dimethylpyrimidin-2(1H)-ylidene]amino}-N-(1,1-dioxidotetrahydrothiophen-3-yl)benzamide
Smiles: Cc1cc(C)[nH]/c(=N\c2ccc(cc2)C(=O)NC2CCS(=O)(=O)C2)/n1
STL311701
Synonyms: 4-{[(2E)-4,6-dimethylpyrimidin-2(1H)-ylidene]amino}-N-(1H-indol-4-yl)benzamide
Smiles: Cc1cc(C)[nH]/c(=N\c2ccc(cc2)C(=O)Nc2cccc3c2cc[nH]3)/n1
STL313553
Synonyms: 4-{[(2E)-4,6-dimethylpyrimidin-2(1H)-ylidene]amino}-N-(1H-indol-5-yl)benzamide
Smiles: Cc1cc(C)[nH]/c(=N\c2ccc(cc2)C(=O)Nc2ccc3c(c2)cc[nH]3)/n1
STL313105
Synonyms: 4-{[(2E)-4,6-dimethylpyrimidin-2(1H)-ylidene]amino}-N-(1H-indol-6-yl)benzamide
Smiles: Cc1cc(C)[nH]/c(=N\c2ccc(cc2)C(=O)Nc2ccc3c(c2)[nH]cc3)/n1