SMILES
stringlengths 2
859
| IUPAC
stringlengths 6
1.34k
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C=CCCCN(C)C(=NC)NCCNS(=O)(=O)CC
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3-[2-(ethylsulfonylamino)ethyl]-1,2-dimethyl-1-pent-4-enylguanidine
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O=C(Nc1nc2ccccc2[nH]1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1
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N-(1H-benzimidazol-2-yl)-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
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O=C(O)CCCCCCC(=O)Nc1cccc(OS(=O)(=O)C2CC3OC2C(c2ccc(O)cc2)=C3c2ccc(O)cc2)c1
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8-[3-[[5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hept-5-en-2-yl]sulfonyloxy]anilino]-8-oxooctanoic acid
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CO[C@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2NC(C)=O)[C@H](O)[C@H]1O
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N-[(2S,3S,4R,5R,6R)-2-[(2R,3S,4R,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
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C=CCc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1OC
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(4-methoxy-3-prop-2-enylphenyl)-[(3R)-3-methylpiperidin-1-yl]methanone
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O=C(NCc1ccc2c(c1)OCO2)c1cc2cc(C3(O)CCN(Cc4cccs4)CC3)ccc2o1
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N-(1,3-benzodioxol-5-ylmethyl)-5-[4-hydroxy-1-(thiophen-2-ylmethyl)piperidin-4-yl]-1-benzofuran-2-carboxamide
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Cn1cc(CN2CC3CN(c4cc(C5CC5)ncn4)CC3C2)cnc1=O
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5-[[5-(6-cyclopropylpyrimidin-4-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]methyl]-1-methylpyrimidin-2-one
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C/C(=N/OC[C@H](O)CNC(C)(C)C)C1CC1.O=C(O)C(=O)O
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(2R)-1-(tert-butylamino)-3-[(Z)-1-cyclopropylethylideneamino]oxypropan-2-ol;oxalic acid
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Cc1ccc(S(=O)(=O)N(CC(=O)N(Cc2cccc(Cl)c2)C(C)C(=O)NC2CCCCC2)c2cc(Cl)ccc2Cl)cc1
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2-[(3-chlorophenyl)methyl-[2-(2,5-dichloro-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]-N-cyclohexylpropanamide
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CN(CCC(=O)Nc1ccc(Cl)cc1F)C(CO)C(C)(C)C
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N-(4-chloro-2-fluorophenyl)-3-[(1-hydroxy-3,3-dimethylbutan-2-yl)-methylamino]propanamide
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CCOC(=O)Nc1ccc2c(COc3ccc4c(CC)cc(=O)oc4c3)cc(=O)oc2c1
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ethyl N-[4-[(4-ethyl-2-oxochromen-7-yl)oxymethyl]-2-oxochromen-7-yl]carbamate
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CCC(C)NC(=O)C(C)N(Cc1ccccc1)C(=O)CN(c1ccc(OCc2ccccc2)cc1)S(C)(=O)=O
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2-[benzyl-[2-(N-methylsulfonyl-4-phenylmethoxyanilino)acetyl]amino]-N-butan-2-ylpropanamide
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COc1ccc(N)c(NCCN2CCC(NC(=O)O)CC2)n1
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[1-[2-[(3-amino-6-methoxypyridin-2-yl)amino]ethyl]piperidin-4-yl]carbamic acid
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CCCCCc1ccc(-c2ncc(-c3ccc(OC(C)C(=O)OCCCC)cc3)cn2)cc1
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butyl 2-[4-[2-(4-pentylphenyl)pyrimidin-5-yl]phenoxy]propanoate
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COCC(C)NC(=O)c1cc[n+](CCC(=O)O)nc1
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3-[4-(1-methoxypropan-2-ylcarbamoyl)pyridazin-1-ium-1-yl]propanoic acid
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CCc1cc(OCC(=O)c2ccccc2)ccc1Cl
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2-(4-chloro-3-ethylphenoxy)-1-phenylethanone
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CCC(CO)(CCCSc1cc(C)nn1C)NC(C)C
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5-(2,5-dimethylpyrazol-3-yl)sulfanyl-2-ethyl-2-(propan-2-ylamino)pentan-1-ol
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Cc1ccc2c(c1)C(=O)N(CCN)CC2
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2-(2-aminoethyl)-7-methyl-3,4-dihydroisoquinolin-1-one
|
CCCOc1ccc2ccccc2c1CN(C)S(=O)(=O)N1CC(C)OC(CCOc2c(OC)ccc(C(=O)NC(C)Cc3ccc(-c4ccccc4)cc3)c2OC)C1
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2,4-dimethoxy-3-[2-[6-methyl-4-[methyl-[(2-propoxynaphthalen-1-yl)methyl]sulfamoyl]morpholin-2-yl]ethoxy]-N-[1-(4-phenylphenyl)propan-2-yl]benzamide
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CCc1nc(S/C(=C\c2cn(C(C)C)c3ccccc23)C(=O)[O-])n[nH]1
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(Z)-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-3-(1-propan-2-ylindol-3-yl)prop-2-enoate
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CC1(C)c2ccccc2-c2nc(-n3c4ccccc4c4cc5ccccc5cc43)c(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc43)nc21.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(-c4nc5oc6ccccc6c5nc4-n4c5ccccc5c5cc6ccccc6cc54)cc32)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2c(-c3nc4oc5ccccc5c4nc3-n3c4ccccc4c4cc5ccccc5cc43)cccc21.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2c(-c3nc4sc5ccccc5c4nc3-n3c4ccccc4c4cc5ccccc5cc43)cccc21
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2-benzo[b]carbazol-5-yl-3-(9,9-diphenylfluoren-2-yl)-[1]benzofuro[2,3-b]pyrazine;2-benzo[b]carbazol-5-yl-3-(9,9'-spirobi[fluorene]-4'-yl)-[1]benzofuro[2,3-b]pyrazine;2-benzo[b]carbazol-5-yl-3-(9,9'-spirobi[fluorene]-4'-yl)-[1]benzothiolo[2,3-b]pyrazine;5-[9,9-dimethyl-2-(9,9'-spirobi[fluorene]-4'-yl)indeno[1,2-b]pyrazin-3-yl]benzo[b]carbazole
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CCOCCCNC(=O)[C@H]1CCCN(Cc2nc(-c3ccc(OC)c(OC)c3)no2)C1
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(3S)-1-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(3-ethoxypropyl)piperidine-3-carboxamide
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COc1c(C(C)(C)C)cc(C(C)(C)C)c(-c2ccccc2)c1OC
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1,5-ditert-butyl-2,3-dimethoxy-4-phenylbenzene
|
O=Cc1cc(CCO)cc(-n2nc3ccc([N+](=O)[O-])cc3n2)c1O
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2-hydroxy-5-(2-hydroxyethyl)-3-(5-nitrobenzotriazol-2-yl)benzaldehyde
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COc1ccc(C(=O)NNC(=O)C(=O)NC2CC2)c(OC)c1OC
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N-cyclopropyl-2-oxo-2-[2-(2,3,4-trimethoxybenzoyl)hydrazinyl]acetamide
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CC(CN(C)C(=O)NCCCS(C)=O)C(=O)O
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2-methyl-3-[methyl(3-methylsulfinylpropylcarbamoyl)amino]propanoic acid
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CCCCC/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCC/C=C\C/C=C\CCCCCC
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[2-[(11Z,14Z)-henicosa-11,14-dienoyl]oxy-3-[(Z)-hexadec-9-enoyl]oxypropyl] (10Z,13Z,16Z)-docosa-10,13,16-trienoate
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CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC
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[(2R)-3-[hydroxy-[(2R)-2-hydroxy-3-[hydroxy-[(2R)-3-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-2-[(Z)-octadec-9-enoyl]oxypropoxy]phosphoryl]oxypropoxy]phosphoryl]oxy-2-[(Z)-octadec-9-enoyl]oxypropyl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
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CCOC1CC(NC(=O)Nc2cnn(CC(C)C)c2)C12CCCC2
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1-(3-ethoxyspiro[3.4]octan-1-yl)-3-[1-(2-methylpropyl)pyrazol-4-yl]urea
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CCCCCCC1C(=O)N(c2ccccc2)N=C1CCC(=O)OC
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methyl 3-(4-hexyl-5-oxo-1-phenyl-4H-pyrazol-3-yl)propanoate
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Nc1cc(C(=O)NC2CCC2)ccc1F
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3-amino-N-cyclobutyl-4-fluorobenzamide
|
CCC(C)CCCC(C)C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C
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2,6-dimethyloctyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane
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Cc1ccc(-c2ccc(OC3CCCCO3)c(F)c2)cc1
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2-[2-fluoro-4-(4-methylphenyl)phenoxy]oxane
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CC(C)c1cc(N2c3ccccc3Oc3cc4c(cc32)[se]c2ccccc24)cc2c(C(C)C)cc(N3c4ccccc4Oc4cc5c(cc43)[se]c3ccccc35)cc12.CC1(C)c2ccccc2-c2cc3c(cc21)N(c1ccc2cc(N4c5ccccc5N(c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c5cc6c(cc54)C(C)(C)c4ccccc4-6)ccc2c1)c1ccccc1N3c1ccccc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c(cc43)N(c3cccc4c(N6c7ccccc7Sc7cc8c9ccccc9n(-c9cccc(-c%10ccccc%10)c9)c8cc76)cccc34)c3ccccc3S5)c2)cc1.c1cncc(-n2c3ccccc3c3cc4c(cc32)N(c2c3ccccc3c(N3c5ccccc5N(c5cccc6c5sc5ccccc56)c5cc6c7ccccc7n(-c7cccnc7)c6cc53)c3ccccc23)c2ccccc2N4c2cccc3c2SC2CCCCC32)c1
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14-[10-[21-(5a,6,7,8,9,9a-hexahydrodibenzothiophen-4-yl)-10-pyridin-3-yl-10,14,21-triazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaen-14-yl]anthracen-9-yl]-21-dibenzothiophen-4-yl-10-pyridin-3-yl-10,14,21-triazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-(10,10-dimethyl-21-phenyl-14,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaen-14-yl)naphthalen-2-yl]-21-(4,6-diphenyl-1,3,5-triazin-2-yl)-10,10-dimethyl-14,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;14-[6-(21-oxa-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaen-14-yl)-4,8-di(propan-2-yl)naphthalen-2-yl]-21-oxa-10-selena-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;10-(3-phenylphenyl)-14-[5-[10-(3-phenylphenyl)-21-thia-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaen-14-yl]naphthalen-1-yl]-21-thia-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
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CNCc1ncc(C(=O)N2CCCC2c2nc3ccc(C)cc3[nH]2)cn1
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[2-(methylaminomethyl)pyrimidin-5-yl]-[2-(6-methyl-1H-benzimidazol-2-yl)pyrrolidin-1-yl]methanone
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Cc1ccc(C(=O)COCc2ccccc2Br)s1
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2-[(2-bromophenyl)methoxy]-1-(5-methylthiophen-2-yl)ethanone
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CCCNc1ccc(C(=O)Nc2nncs2)cc1
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4-(propylamino)-N-(1,3,4-thiadiazol-2-yl)benzamide
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OCCC1CC2=C(CC=CC2)C1
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2-(2,3,4,7-tetrahydro-1H-inden-2-yl)ethanol
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N#Cc1cc2c(nc1N)CCNC2
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2-amino-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile
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O=C(c1cc(-c2ccc(Cl)cc2Cl)n[nH]1)N1CCCCC1
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[3-(2,4-dichlorophenyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone
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CC(c1ccccc1)N1CCC(NC(=O)c2ccc(-n3ccc(C(F)(F)F)n3)cc2)CC1
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N-[1-(1-phenylethyl)piperidin-4-yl]-4-[3-(trifluoromethyl)pyrazol-1-yl]benzamide
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O=C(NC1CCOc2ccccc21)c1ccc2c(c1)C(=O)c1ccccc1-2
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N-(3,4-dihydro-2H-chromen-4-yl)-9-oxofluorene-2-carboxamide
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CCc1cnc2c(Cl)[nH]nc2c1
|
3-chloro-6-ethyl-2H-pyrazolo[4,3-b]pyridine
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Cc1cc[n+](CCS(=O)(=O)O)cc1
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2-(4-methylpyridin-1-ium-1-yl)ethanesulfonic acid
|
CCCCCCC/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
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[2-[(21Z,24Z)-dotriaconta-21,24-dienoyl]oxy-3-hydroxypropyl] nonatriacontanoate
|
O=C(Cc1c(F)cccc1Cl)c1cc(F)cc([N+](=O)[O-])c1
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2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-5-nitrophenyl)ethanone
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CC.O=C(NP)c1cc2c(s1)-c1ccccc1S(=O)(=O)C2
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5,5-dioxo-N-phosphanyl-4H-thieno[3,2-c]thiochromene-2-carboxamide;ethane
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CCNC(c1ccc(CC)cc1)c1csnn1
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N-[(4-ethylphenyl)-(thiadiazol-4-yl)methyl]ethanamine
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CCC(N)=O.[K+].[OH-]
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potassium;propanamide;hydroxide
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Fc1cccc(Nc2nccs2)c1
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N-(3-fluorophenyl)-1,3-thiazol-2-amine
|
COC(=O)N[C@H](C(=O)NC(Cc1ccccc1)[C@@H](O)CN(Cc1cccs1)NC(=O)[C@@H](NC(=O)OC)C(C)C)C(C)C
|
methyl N-[(2S)-1-[2-[(2S)-2-hydroxy-3-[[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]amino]-4-phenylbutyl]-2-(thiophen-2-ylmethyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]carbamate
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CC1(C)N=C(c2ccc(O)cc2)N(O)C1(C)C
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4-(1-hydroxy-4,4,5,5-tetramethylimidazol-2-yl)phenol
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Cc1cccc(/C=N\NC(=O)CSc2ccccc2C)n1
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2-(2-methylphenyl)sulfanyl-N-[(Z)-(6-methylpyridin-2-yl)methylideneamino]acetamide
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O=C(O)CC[C@@H](O)C[C@H](O)CO
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(4R,6S)-4,6,7-trihydroxyheptanoic acid
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COCCN1CC[C@H](C)N2C(=O)c3c(O)c(=O)c(CNCc4ccc(F)cc4)cn3C[C@@H]12
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(3S,7S)-13-[[(4-fluorophenyl)methylamino]methyl]-11-hydroxy-4-(2-methoxyethyl)-7-methyl-1,4,8-triazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-9,12-dione
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COc1cccc(C(=O)NCC2CCC(Cl)CC2)c1
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N-[(4-chlorocyclohexyl)methyl]-3-methoxybenzamide
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CC(C)(C)S(=O)(=O)N1CCN(c2cnn(-c3cccc(Cl)c3)c(=O)c2OC2CCCC2)CC1.CC(C)(C)S(=O)N1CCN(c2cnn(-c3cccc(Cl)c3)c(=O)c2OC2CCCC2)CC1
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5-(4-tert-butylsulfinylpiperazin-1-yl)-2-(3-chlorophenyl)-4-cyclopentyloxypyridazin-3-one;5-(4-tert-butylsulfonylpiperazin-1-yl)-2-(3-chlorophenyl)-4-cyclopentyloxypyridazin-3-one
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c1ccc2c3[nH]c4ccc5ccccc5c4cc-3cc2c1
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2-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),3,5,7,9,11,14,16,18,20-decaene
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CCNC(=O)COc1cccc(CNC(=NC)NC(C)c2cccc3ccccc23)c1
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N-ethyl-2-[3-[[[N'-methyl-N-(1-naphthalen-1-ylethyl)carbamimidoyl]amino]methyl]phenoxy]acetamide
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CCCC[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC[C@@H](N)CS)C(C)C)C(=O)O
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(2S)-2-[[(3S)-2-[(2S)-2-[[(2R)-2-amino-3-sulfanylpropyl]amino]-3-methylbutanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]hexanoic acid
|
CCOC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)C(C)C
|
ethyl (2S)-3-methyl-2-[[(2S)-1-(2-phenylacetyl)pyrrolidine-2-carbonyl]amino]butanoate
|
CC1=C[C@H](c2ccc(F)cc2Cl)N=C(c2nccs2)N1
|
2-[(4R)-4-(2-chloro-4-fluorophenyl)-6-methyl-1,4-dihydropyrimidin-2-yl]-1,3-thiazole
|
O=C(CN(Cc1ccc(F)cc1)C(=O)Cn1nnc2ccccc21)Nc1ccc2c(c1)OCO2
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N-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2-(benzotriazol-1-yl)-N-[(4-fluorophenyl)methyl]acetamide
|
O=c1c2ccccc2[nH]n1CC=Cc1ccccc1
|
2-(3-phenylprop-2-enyl)-1H-indazol-3-one
|
COc1cc(O)cc(C)c1CN1CCNCC1
|
3-methoxy-5-methyl-4-(piperazin-1-ylmethyl)phenol
|
CN(C)C(=NC[C@@H]1C[C@H]1C1CC1)N(C)C
|
2-[[(1R,2S)-2-cyclopropylcyclopropyl]methyl]-1,1,3,3-tetramethylguanidine
|
CN1CC(OC(=O)Oc2ccc([N+](=O)[O-])cc2)CN1C(=O)Cc1ccc(F)cc1
|
[1-[2-(4-fluorophenyl)acetyl]-2-methylpyrazolidin-4-yl] (4-nitrophenyl) carbonate
|
Cc1cc(OC(F)(F)P(C)(=O)O)cc(C)c1Oc1ccc(O)c(C(C)C)c1
|
[difluoro-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylphenoxy]methyl]-methylphosphinic acid
|
CN=C(NCc1nc(-c2ccc(Cl)cc2)no1)NC1CCN(c2cccc(C)n2)CC1.I
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1-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methyl-3-[1-(6-methylpyridin-2-yl)piperidin-4-yl]guanidine;hydroiodide
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COc1cc(F)c(F)cc1Cn1cc(CNc2cc3c(c(C)n2)NC(=O)[C@H](C)N3C)nn1
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(2S)-7-[[1-[(4,5-difluoro-2-methoxyphenyl)methyl]triazol-4-yl]methylamino]-1,2,5-trimethyl-2,4-dihydropyrido[3,4-b]pyrazin-3-one
|
Cc1oncc1C(=O)N(Cc1ccsc1)Cc1ccco1
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N-(furan-2-ylmethyl)-5-methyl-N-(thiophen-3-ylmethyl)-1,2-oxazole-4-carboxamide
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CC(C)(C)OC(=O)N1CCC1CC1CO1
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tert-butyl 2-(oxiran-2-ylmethyl)azetidine-1-carboxylate
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COc1ccc(N2C(=O)c3ccccc3N[C@H]2c2ncc[nH]2)cc1
|
(2R)-2-(1H-imidazol-2-yl)-3-(4-methoxyphenyl)-1,2-dihydroquinazolin-4-one
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Nc1ccc(-c2nc(-c3ncccc3Cl)no2)c(F)c1
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4-[3-(3-chloropyridin-2-yl)-1,2,4-oxadiazol-5-yl]-3-fluoroaniline
|
COC(=O)c1c(C)c(C)c([Si](C(C)C)(C(C)C)C(C)C)c(O)c1C(=O)OC
|
dimethyl 3-hydroxy-5,6-dimethyl-4-tri(propan-2-yl)silylbenzene-1,2-dicarboxylate
|
CCOC(=O)Cn1c(=O)cnc2ccc(OC)cc21
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ethyl 2-(7-methoxy-2-oxoquinoxalin-1-yl)acetate
|
Fc1ccc(-c2cnc(COc3ccc4c(c3)OCO4)o2)cc1
|
2-(1,3-benzodioxol-5-yloxymethyl)-5-(4-fluorophenyl)-1,3-oxazole
|
CC(C)(C)c1cccc2c1oc1c(C(C)(C)C)ccc(-c3ccccc3N3c4ccccc4B4c5ccccc5N(c5ccccc5)c5cccc3c54)c12.c1ccc(-c2c(-c3ccccc3N3c4ccccc4B4c5ccccc5N(c5ccccc5)c5cccc3c54)ccc3c2oc2c(-c4cc5ccccc5c5ccccc45)cccc23)cc1.c1ccc(-c2cccc3c2oc2c(-c4ccccc4)c(-c4ccccc4N4c5ccccc5B5c6ccccc6N(c6ccccc6)c6cccc4c65)ccc23)cc1.c1ccc(N2c3ccccc3B3c4ccccc4N(c4ccccc4-c4cccc5c4oc4c(-c6cccc7ccccc67)cccc45)c4cccc2c43)cc1
|
8-[2-(4,6-ditert-butyldibenzofuran-1-yl)phenyl]-14-phenyl-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene;8-[2-(4,6-diphenyldibenzofuran-3-yl)phenyl]-14-phenyl-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene;8-[2-(6-naphthalen-1-yldibenzofuran-4-yl)phenyl]-14-phenyl-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene;8-[2-(6-phenanthren-9-yl-4-phenyldibenzofuran-3-yl)phenyl]-14-phenyl-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene
|
O=c1[nH]c(CCCO)nn1Cc1ccccc1
|
2-benzyl-5-(3-hydroxypropyl)-4H-1,2,4-triazol-3-one
|
O=c1ccn([C@@H]2O[C@]3(F)C(OP(=O)(NC4CCC4)Oc4ccc(Cl)cc4)[C@]3(O)[C@]23CCS3)c(=O)[nH]1
|
1-[(1S,3R,4R,5R)-6-[(4-chlorophenoxy)-(cyclobutylamino)phosphoryl]oxy-1-fluoro-5-hydroxyspiro[2-oxabicyclo[3.1.0]hexane-4,2'-thietane]-3-yl]pyrimidine-2,4-dione
|
Cc1nnc2sc(C(=O)N3CC(Sc4ccc(F)c(F)c4)C3)c(N)c2c1C
|
(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3,4-difluorophenyl)sulfanylazetidin-1-yl]methanone
|
COc1ccccc1N1C[C@H](C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)CC1=O
|
(3R)-1-(2-methoxyphenyl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-5-oxopyrrolidine-3-carboxamide
|
COC[C@H]1CN([C@@H](Cc2ccc3c(c2)CCC3)C(=O)OC(C)(C)C)CCN1C(=O)[C@@H]1CN(c2ccc(F)cc2)C[C@H]1c1ccc(F)cc1F
|
tert-butyl (2S)-2-[(3R)-4-[(3S,4R)-4-(2,4-difluorophenyl)-1-(4-fluorophenyl)pyrrolidine-3-carbonyl]-3-(methoxymethyl)piperazin-1-yl]-3-(2,3-dihydro-1H-inden-5-yl)propanoate
|
Nc1nc(CNc2nccc(CCC(F)(F)F)n2)cs1
|
4-[[[4-(3,3,3-trifluoropropyl)pyrimidin-2-yl]amino]methyl]-1,3-thiazol-2-amine
|
CCc1c(CN(C)S(=O)(=O)c2ccc3ccccc3c2)c(C)nn1C
|
N-[(5-ethyl-1,3-dimethylpyrazol-4-yl)methyl]-N-methylnaphthalene-2-sulfonamide
|
CC(C)(C)N(C(=O)O)C1CCC(n2cc(N)cn2)CC1
|
[4-(4-aminopyrazol-1-yl)cyclohexyl]-tert-butylcarbamic acid
|
COc1cc(C)c(C2(CNC(C)C)COC2)cc1C
|
N-[[3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]methyl]propan-2-amine
|
Cn1c(CO)nnc1Sc1nc2ccccc2s1
|
[5-(1,3-benzothiazol-2-ylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]methanol
|
CCCN1CCc2nc(CC(=O)OC)sc2C1
|
methyl 2-(5-propyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetate
|
CN=C(NCc1ccc(OC)c(OC)c1)NCc1cc(C#N)ccc1F.I
|
1-[(5-cyano-2-fluorophenyl)methyl]-3-[(3,4-dimethoxyphenyl)methyl]-2-methylguanidine;hydroiodide
|
O=C(CBr)c1ccc(-n2cccn2)nc1
|
2-bromo-1-(6-pyrazol-1-ylpyridin-3-yl)ethanone
|
C#CCOc1cccc(/C=N/NC(=O)c2ccc(OCC)cc2)c1
|
4-ethoxy-N-[(E)-(3-prop-2-ynoxyphenyl)methylideneamino]benzamide
|
CCNC(=NCCCc1nnc(SC)n1C1CCCC1)NC(C)CCC(C)C.I
|
2-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-1-ethyl-3-(5-methylhexan-2-yl)guanidine;hydroiodide
|
COc1cc(CNC(=O)N2CCN3CCCC[C@@H]3C2)ccn1
|
(9aR)-N-[(2-methoxypyridin-4-yl)methyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide
|
CCC(=O)N1CCCC(C(=O)N2CCN(S(=O)(=O)c3cccc(F)c3)CC2)C1
|
1-[3-[4-(3-fluorophenyl)sulfonylpiperazine-1-carbonyl]piperidin-1-yl]propan-1-one
|
CNCC(=O)NC(C(=O)OC)C(C)C.Cl
|
methyl 3-methyl-2-[[2-(methylamino)acetyl]amino]butanoate;hydrochloride
|
C1C2CC3CC1CC(C2)C3.O=C(O)/C=C/c1ccccc1
|
adamantane;(E)-3-phenylprop-2-enoic acid
|
CCN1CCCC(O)(C2(CN)CCCOC2)CC1
|
4-[3-(aminomethyl)oxan-3-yl]-1-ethylazepan-4-ol
|
Cc1cc(C(F)(F)F)c(C#N)c(SCc2ccccc2F)n1
|
2-[(2-fluorophenyl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile
|
CC(N)C(C)(C)NC(=O)C1C2C3CCC(C3)C12
|
N-(3-amino-2-methylbutan-2-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide
|
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