Product OPENEYE NAME: 4-(4-butylphenyl)-5-ethyl-3-methyl-1H-imidazol-2-one
CAS Name: 4-(4-butylphenyl)-5-ethyl-3-methyl-1H-imidazol-2-one
IUPAC NAME: 4-(4-butylphenyl)-5-ethyl-3-methyl-1H-imidazol-2-one
SYSTEMATIC NAME: 4-(4-butylphenyl)-5-ethyl-3-methyl-1H-imidazol-2-one
MOLECULAR FORMULA: C16H22N2O
MOLECULAR WEIGHT: 258.35868
SMILES: CCCCC1=CC=C(C=C1)C2=C(NC(=O)N2C)CC
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Product OPENEYE NAME: N-[3-[(1R,5S)-3-(3-isopropyl-5-methyl-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-N-phenyl-cyclohexanecarboxamide
CAS Name: N-[3-[(1R,5S)-3-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-N-phenylcyclohexanecarboxamide
IUPAC NAME: N-[3-[(1R,5S)-3-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-N-phenylcyclohexanecarboxamide
SYSTEMATIC NAME: N-[3-[(1R,5S)-3-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-N-phenyl-cyclohexanecarboxamide
MOLECULAR FORMULA: C29H43N5O
MOLECULAR WEIGHT: 477.68462
SMILES: CC1=NN=C(N1C2C[C@H]3CC[C@@H](C2)N3CCCN(C4=CC=CC=C4)C(=O)C5CCCCC5)C(C)C
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Product OPENEYE NAME: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1R)-1-(4-ethyl-4-hydroxy-hexyl)sulfanylethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
CAS Name: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1R)-1-[(4-ethyl-4-hydroxyhexyl)thio]ethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
IUPAC NAME: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1R)-1-(4-ethyl-4-hydroxyhexyl)sulfanylethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
SYSTEMATIC NAME: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1R)-1-(4-ethyl-4-oxidanyl-hexyl)sulfanylethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
MOLECULAR FORMULA: C28H46O3S
MOLECULAR WEIGHT: 462.72804
SMILES: CCC(CC)(CCCS[C@H](C)C1=CCC\2[C@@]1(CCC/C2=C\C=C3C[C@H](C[C@@H](C3)O)O)C)O
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Product OPENEYE NAME: methyl 2-[4-[[(2-ethyl-2-hydroxy-butanoyl)amino]methyl]-3-fluoro-phenyl]-6-fluoro-benzoate
CAS Name: 2-[4-[[(2-ethyl-2-hydroxy-1-oxobutyl)amino]methyl]-3-fluorophenyl]-6-fluorobenzoic acid methyl ester
IUPAC NAME: methyl 2-[4-[[(2-ethyl-2-hydroxybutanoyl)amino]methyl]-3-fluorophenyl]-6-fluorobenzoate
SYSTEMATIC NAME: methyl 2-[4-[[(2-ethyl-2-oxidanyl-butanoyl)amino]methyl]-3-fluoranyl-phenyl]-6-fluoranyl-benzoate
MOLECULAR FORMULA: C21H23F2NO4
MOLECULAR WEIGHT: 391.408426
SMILES: CCC(CC)(C(=O)NCC1=C(C=C(C=C1)C2=C(C(=CC=C2)F)C(=O)OC)F)O
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Product OPENEYE NAME: methyl 2-fluoro-6-[3-fluoro-4-[[[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propanoyl]amino]methyl]phenyl]benzoate
CAS Name: 2-fluoro-6-[3-fluoro-4-[[[3,3,3-trifluoro-2-hydroxy-1-oxo-2-(trifluoromethyl)propyl]amino]methyl]phenyl]benzoic acid methyl ester
IUPAC NAME: methyl 2-fluoro-6-[3-fluoro-4-[[[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propanoyl]amino]methyl]phenyl]benzoate
SYSTEMATIC NAME: methyl 2-fluoranyl-6-[3-fluoranyl-4-[[[3,3,3-tris(fluoranyl)-2-oxidanyl-2-(trifluoromethyl)propanoyl]amino]methyl]phenyl]benzoate
MOLECULAR FORMULA: C19H13F8NO4
MOLECULAR WEIGHT: 471.298046
SMILES: COC(=O)C1=C(C=CC=C1F)C2=CC(=C(C=C2)CNC(=O)C(C(F)(F)F)(C(F)(F)F)O)F
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Product OPENEYE NAME: methyl 2-fluoro-6-[3-fluoro-4-[[(2-hydroxy-2-methyl-propanoyl)amino]methyl]phenyl]benzoate
CAS Name: 2-fluoro-6-[3-fluoro-4-[[(2-hydroxy-2-methyl-1-oxopropyl)amino]methyl]phenyl]benzoic acid methyl ester
IUPAC NAME: methyl 2-fluoro-6-[3-fluoro-4-[[(2-hydroxy-2-methylpropanoyl)amino]methyl]phenyl]benzoate
SYSTEMATIC NAME: methyl 2-fluoranyl-6-[3-fluoranyl-4-[[(2-methyl-2-oxidanyl-propanoyl)amino]methyl]phenyl]benzoate
MOLECULAR FORMULA: C19H19F2NO4
MOLECULAR WEIGHT: 363.355266
SMILES: CC(C)(C(=O)NCC1=C(C=C(C=C1)C2=C(C(=CC=C2)F)C(=O)OC)F)O
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Product OPENEYE NAME: N-cyano-4-[2-(3,4-dimethoxyphenyl)acetyl]-3,5-dimethyl-N'-(o-tolyl)piperazine-1-carboxamidine
CAS Name: N-cyano-4-[2-(3,4-dimethoxyphenyl)-1-oxoethyl]-3,5-dimethyl-N'-(2-methylphenyl)-1-piperazinecarboximidamide
IUPAC NAME: N-cyano-4-[2-(3,4-dimethoxyphenyl)acetyl]-3,5-dimethyl-N'-(2-methylphenyl)piperazine-1-carboximidamide
SYSTEMATIC NAME: N-cyano-4-[2-(3,4-dimethoxyphenyl)ethanoyl]-3,5-dimethyl-N'-(2-methylphenyl)piperazine-1-carboximidamide
MOLECULAR FORMULA: C25H31N5O3
MOLECULAR WEIGHT: 449.54534
SMILES: CC1CN(CC(N1C(=O)CC2=CC(=C(C=C2)OC)OC)C)C(=NC3=CC=CC=C3C)NC#N
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Product OPENEYE NAME: (E)-3-(2-furyl)-N-[3-(hydroxymethyl)-4-morpholino-phenyl]prop-2-enamide
CAS Name: (E)-3-(2-furanyl)-N-[3-(hydroxymethyl)-4-(4-morpholinyl)phenyl]-2-propenamide
IUPAC NAME: (E)-3-(furan-2-yl)-N-[3-(hydroxymethyl)-4-morpholin-4-ylphenyl]prop-2-enamide
SYSTEMATIC NAME: (E)-3-(furan-2-yl)-N-[3-(hydroxymethyl)-4-morpholin-4-yl-phenyl]prop-2-enamide
MOLECULAR FORMULA: C18H20N2O4
MOLECULAR WEIGHT: 328.3624
SMILES: C1COCCN1C2=C(C=C(C=C2)NC(=O)/C=C/C3=CC=CO3)CO
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Product OPENEYE NAME: (E)-N-[3-(hydroxymethyl)-4-morpholino-phenyl]-3-(2-thienyl)prop-2-enamide
CAS Name: (E)-N-[3-(hydroxymethyl)-4-(4-morpholinyl)phenyl]-3-thiophen-2-yl-2-propenamide
IUPAC NAME: (E)-N-[3-(hydroxymethyl)-4-morpholin-4-ylphenyl]-3-thiophen-2-ylprop-2-enamide
SYSTEMATIC NAME: (E)-N-[3-(hydroxymethyl)-4-morpholin-4-yl-phenyl]-3-thiophen-2-yl-prop-2-enamide
MOLECULAR FORMULA: C18H20N2O3S
MOLECULAR WEIGHT: 344.428
SMILES: C1COCCN1C2=C(C=C(C=C2)NC(=O)/C=C/C3=CC=CS3)CO
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Product OPENEYE NAME: [3-(4-methoxyphenyl)-5-(4-phenylphenyl)-3,4-dihydropyrazol-2-yl]-phenyl-methanone
CAS Name: [3-(4-methoxyphenyl)-5-(4-phenylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone
IUPAC NAME: [3-(4-methoxyphenyl)-5-(4-phenylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone
SYSTEMATIC NAME: [3-(4-methoxyphenyl)-5-(4-phenylphenyl)-3,4-dihydropyrazol-2-yl]-phenyl-methanone
MOLECULAR FORMULA: C29H24N2O2
MOLECULAR WEIGHT: 432.51306
SMILES: COC1=CC=C(C=C1)C2CC(=NN2C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C5=CC=CC=C5
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Product OPENEYE NAME: (2R)-2-[[8-amino-2-[(2,3-difluorophenyl)methylsulfanyl]-7H-purin-6-yl]amino]propan-1-ol
CAS Name: (2R)-2-[[8-amino-2-[(2,3-difluorophenyl)methylthio]-7H-purin-6-yl]amino]-1-propanol
IUPAC NAME: (2R)-2-[[8-amino-2-[(2,3-difluorophenyl)methylsulfanyl]-7H-purin-6-yl]amino]propan-1-ol
SYSTEMATIC NAME: (2R)-2-[[8-azanyl-2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-7H-purin-6-yl]amino]propan-1-ol
MOLECULAR FORMULA: C15H16F2N6OS
MOLECULAR WEIGHT: 366.388946
SMILES: C[C@H](CO)NC1=NC(=NC2=C1NC(=N2)N)SCC3=C(C(=CC=C3)F)F
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Product OPENEYE NAME: phenyl-[5-(4-phenylphenyl)-3-(p-tolyl)-3,4-dihydropyrazol-2-yl]methanone
CAS Name: [3-(4-methylphenyl)-5-(4-phenylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone
IUPAC NAME: [3-(4-methylphenyl)-5-(4-phenylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone
SYSTEMATIC NAME: [3-(4-methylphenyl)-5-(4-phenylphenyl)-3,4-dihydropyrazol-2-yl]-phenyl-methanone
MOLECULAR FORMULA: C29H24N2O
MOLECULAR WEIGHT: 416.51366
SMILES: CC1=CC=C(C=C1)C2CC(=NN2C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C5=CC=CC=C5
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Product OPENEYE NAME: 4-[2-[(2R)-2-[(E,3S)-3-hydroxynon-1-enyl]-5-oxo-pyrrolidin-1-yl]ethyl]benzoic acid
CAS Name: 4-[2-[(2R)-2-[(E,3S)-3-hydroxynon-1-enyl]-5-oxo-1-pyrrolidinyl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[(2R)-2-[(E,3S)-3-hydroxynon-1-enyl]-5-oxopyrrolidin-1-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[(5R)-2-oxidanylidene-5-[(E,3S)-3-oxidanylnon-1-enyl]pyrrolidin-1-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C22H31NO4
MOLECULAR WEIGHT: 373.48584
SMILES: CCCCCC[C@@H](/C=C/[C@H]1CCC(=O)N1CCC2=CC=C(C=C2)C(=O)O)O
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