Sunday, November 27, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 1-[(3R,4R)-1-(indan-2-ylmethyl)-3-methoxy-4-piperidyl]-2,5-dimethyl-benzimidazole
CAS Name: 1-[(3R,4R)-1-(2,3-dihydro-1H-inden-2-ylmethyl)-3-methoxy-4-piperidinyl]-2,5-dimethylbenzimidazole
IUPAC NAME: 1-[(3R,4R)-1-(2,3-dihydro-1H-inden-2-ylmethyl)-3-methoxypiperidin-4-yl]-2,5-dimethylbenzimidazole
SYSTEMATIC NAME: 1-[(3R,4R)-1-(2,3-dihydro-1H-inden-2-ylmethyl)-3-methoxy-piperidin-4-yl]-2,5-dimethyl-benzimidazole
MOLECULAR FORMULA: C25H31N3O
MOLECULAR WEIGHT: 389.53314
SMILES: CC1=CC2=C(C=C1)N(C(=N2)C)[C@@H]3CCN(C[C@H]3OC)CC4CC5=CC=CC=C5C4
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Product OPENEYE NAME: 2-[1-[(3R,4R)-1-[[(2S)-5-bromoindan-2-yl]methyl]-3-methoxy-4-piperidyl]-5-methyl-benzimidazol-2-yl]propan-2-ol
CAS Name: 2-[1-[(3R,4R)-1-[[(2S)-5-bromo-2,3-dihydro-1H-inden-2-yl]methyl]-3-methoxy-4-piperidinyl]-5-methyl-2-benzimidazolyl]-2-propanol
IUPAC NAME: 2-[1-[(3R,4R)-1-[[(2S)-5-bromo-2,3-dihydro-1H-inden-2-yl]methyl]-3-methoxypiperidin-4-yl]-5-methylbenzimidazol-2-yl]propan-2-ol
SYSTEMATIC NAME: 2-[1-[(3R,4R)-1-[[(2S)-5-bromanyl-2,3-dihydro-1H-inden-2-yl]methyl]-3-methoxy-piperidin-4-yl]-5-methyl-benzimidazol-2-yl]propan-2-ol
MOLECULAR FORMULA: C27H34BrN3O2
MOLECULAR WEIGHT: 512.48176
SMILES: CC1=CC2=C(C=C1)N(C(=N2)C(C)(C)O)[C@@H]3CCN(C[C@H]3OC)C[C@H]4CC5=C(C4)C=C(C=C5)Br
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Product OPENEYE NAME: N1-[(1S,2R)-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-2-[(2R,4S)-4-[(2-methoxyphenyl)methyl]-2-piperidyl]ethyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
CAS Name: N1-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4S)-4-[(2-methoxyphenyl)methyl]-2-piperidinyl]propan-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide
IUPAC NAME: 1-N-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4S)-4-[(2-methoxyphenyl)methyl]piperidin-2-yl]propan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide
SYSTEMATIC NAME: N1-[(1R,2S)-3-[3,5-bis(fluoranyl)phenyl]-1-[(2R,4S)-4-[(2-methoxyphenyl)methyl]piperidin-2-yl]-1-oxidanyl-propan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
MOLECULAR FORMULA: C37H47F2N3O4
MOLECULAR WEIGHT: 635.783586
SMILES: CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)N[C@@H](CC2=CC(=CC(=C2)F)F)[C@@H]([C@H]3C[C@H](CCN3)CC4=CC=CC=C4OC)O)C
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Product OPENEYE NAME: N1-[(1S,2R)-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-2-[(2R,4S)-4-[(3-methoxyphenyl)methyl]-2-piperidyl]ethyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
CAS Name: N1-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4S)-4-[(3-methoxyphenyl)methyl]-2-piperidinyl]propan-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide
IUPAC NAME: 1-N-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4S)-4-[(3-methoxyphenyl)methyl]piperidin-2-yl]propan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide
SYSTEMATIC NAME: N1-[(1R,2S)-3-[3,5-bis(fluoranyl)phenyl]-1-[(2R,4S)-4-[(3-methoxyphenyl)methyl]piperidin-2-yl]-1-oxidanyl-propan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
MOLECULAR FORMULA: C37H47F2N3O4
MOLECULAR WEIGHT: 635.783586
SMILES: CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)N[C@@H](CC2=CC(=CC(=C2)F)F)[C@@H]([C@H]3C[C@H](CCN3)CC4=CC(=CC=C4)OC)O)C
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Product OPENEYE NAME: N1-[(1S,2R)-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-2-[(2R,4S)-4-[(4-methoxyphenyl)methyl]-2-piperidyl]ethyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
CAS Name: N1-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4S)-4-[(4-methoxyphenyl)methyl]-2-piperidinyl]propan-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide
IUPAC NAME: 1-N-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4S)-4-[(4-methoxyphenyl)methyl]piperidin-2-yl]propan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide
SYSTEMATIC NAME: N1-[(1R,2S)-3-[3,5-bis(fluoranyl)phenyl]-1-[(2R,4S)-4-[(4-methoxyphenyl)methyl]piperidin-2-yl]-1-oxidanyl-propan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
MOLECULAR FORMULA: C37H47F2N3O4
MOLECULAR WEIGHT: 635.783586
SMILES: CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)N[C@@H](CC2=CC(=CC(=C2)F)F)[C@@H]([C@H]3C[C@H](CCN3)CC4=CC=C(C=C4)OC)O)C
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Product OPENEYE NAME: (Z)-3-[(3E)-3-[2-isopentyl-3,5-dioxo-6-(2-thienyl)pyridazin-4-ylidene]-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-7-yl]prop-2-enamide
CAS Name: (Z)-3-[(3E)-3-[2-(3-methylbutyl)-3,5-dioxo-6-thiophen-2-yl-4-pyridazinylidene]-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-7-yl]-2-propenamide
IUPAC NAME: (Z)-3-[(3E)-3-[2-(3-methylbutyl)-3,5-dioxo-6-thiophen-2-ylpyridazin-4-ylidene]-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-7-yl]prop-2-enamide
SYSTEMATIC NAME: (Z)-3-[(3E)-3-[2-(3-methylbutyl)-3,5-bis(oxidanylidene)-6-thiophen-2-yl-pyridazin-4-ylidene]-1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-7-yl]prop-2-enamide
MOLECULAR FORMULA: C23H23N5O5S2
MOLECULAR WEIGHT: 513.58922
SMILES: CC(C)CCN1C(=O)/C(=C/2\NC3=C(C=C(C=C3)/C=C\C(=O)N)S(=O)(=O)N2)/C(=O)C(=N1)C4=CC=CS4
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Product OPENEYE NAME: 2-[(1R,2R)-2-[(dimethylamino)methyl]-1-(3-methoxyphenyl)cyclohexoxy]ethanol
CAS Name: 2-[(1R,2R)-2-[(dimethylamino)methyl]-1-(3-methoxyphenyl)cyclohexyl]oxyethanol
IUPAC NAME: 2-[(1R,2R)-2-[(dimethylamino)methyl]-1-(3-methoxyphenyl)cyclohexyl]oxyethanol
SYSTEMATIC NAME: 2-[(1R,2R)-2-[(dimethylamino)methyl]-1-(3-methoxyphenyl)cyclohexyl]oxyethanol
MOLECULAR FORMULA: C18H29NO3
MOLECULAR WEIGHT: 307.42776
SMILES: CN(C)C[C@H]1CCCC[C@@]1(C2=CC(=CC=C2)OC)OCCO
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Product OPENEYE NAME: 3,5-dimethyl-4-(4-octadecylphenyl)-1H-imidazol-2-one
CAS Name: 3,5-dimethyl-4-(4-octadecylphenyl)-1H-imidazol-2-one
IUPAC NAME: 3,5-dimethyl-4-(4-octadecylphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 3,5-dimethyl-4-(4-octadecylphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C29H48N2O
MOLECULAR WEIGHT: 440.70422
SMILES: CCCCCCCCCCCCCCCCCCC1=CC=C(C=C1)C2=C(NC(=O)N2C)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H34O6
MOLECULAR WEIGHT: 490.58736
SMILES: C[C@@H]1CC[C@H]2[C@H]([C@@H](O[C@H]3[C@@]24[C@H]1CC[C@@](O3)(OO4)C)OC(=O)CC5C6=CC=CC=C6C7=CC=CC=C57)C
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Product OPENEYE NAME: 3,5-dimethyl-4-(4-undecoxyphenyl)-1H-imidazol-2-one
CAS Name: 3,5-dimethyl-4-(4-undecoxyphenyl)-1H-imidazol-2-one
IUPAC NAME: 3,5-dimethyl-4-(4-undecoxyphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 3,5-dimethyl-4-(4-undecoxyphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C22H34N2O2
MOLECULAR WEIGHT: 358.51756
SMILES: CCCCCCCCCCCOC1=CC=C(C=C1)C2=C(NC(=O)N2C)C
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Product OPENEYE NAME: 3,5-dimethyl-4-(4-tetradecylphenyl)-1H-imidazol-2-one
CAS Name: 3,5-dimethyl-4-(4-tetradecylphenyl)-1H-imidazol-2-one
IUPAC NAME: 3,5-dimethyl-4-(4-tetradecylphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 3,5-dimethyl-4-(4-tetradecylphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C25H40N2O
MOLECULAR WEIGHT: 384.5979
SMILES: CCCCCCCCCCCCCCC1=CC=C(C=C1)C2=C(NC(=O)N2C)C
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Product OPENEYE NAME: N-cyano-4-[2-(3-methylpyrazol-1-yl)acetyl]-N'-(o-tolyl)-3-phenyl-piperazine-1-carboxamidine
CAS Name: N-cyano-N'-(2-methylphenyl)-4-[2-(3-methyl-1-pyrazolyl)-1-oxoethyl]-3-phenyl-1-piperazinecarboximidamide
IUPAC NAME: N-cyano-N'-(2-methylphenyl)-4-[2-(3-methylpyrazol-1-yl)acetyl]-3-phenylpiperazine-1-carboximidamide
SYSTEMATIC NAME: N-cyano-N'-(2-methylphenyl)-4-[2-(3-methylpyrazol-1-yl)ethanoyl]-3-phenyl-piperazine-1-carboximidamide
MOLECULAR FORMULA: C25H27N7O
MOLECULAR WEIGHT: 441.52818
SMILES: CC1=NN(C=C1)CC(=O)N2CCN(CC2C3=CC=CC=C3)C(=NC4=CC=CC=C4C)NC#N
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Product OPENEYE NAME: 4-(4-dodecylphenyl)-3,5-dimethyl-1H-imidazol-2-one
CAS Name: 4-(4-dodecylphenyl)-3,5-dimethyl-1H-imidazol-2-one
IUPAC NAME: 4-(4-dodecylphenyl)-3,5-dimethyl-1H-imidazol-2-one
SYSTEMATIC NAME: 4-(4-dodecylphenyl)-3,5-dimethyl-1H-imidazol-2-one
MOLECULAR FORMULA: C23H36N2O
MOLECULAR WEIGHT: 356.54474
SMILES: CCCCCCCCCCCCC1=CC=C(C=C1)C2=C(NC(=O)N2C)C
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