Monday, November 28, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 5-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]-3-isobutyl-imidazo[4,5-b]pyridine; methanesulfonic acid
CAS Name: 5-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine; methanesulfonic acid
IUPAC NAME: 5-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine; methanesulfonic acid
SYSTEMATIC NAME: 5-[2-[2,6-bis(fluoranyl)phenyl]-4-phenyl-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine; methanesulfonic acid
MOLECULAR FORMULA: C26H25F2N5O3S
MOLECULAR WEIGHT: 525.570206
SMILES: CC(C)CN1C=NC2=C1N=C(C=C2)C3=C(N=C(N3)C4=C(C=CC=C4F)F)C5=CC=CC=C5.CS(=O)(=O)O
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Product OPENEYE NAME: 5-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]-3-isobutyl-imidazo[4,5-b]pyridine
CAS Name: 5-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine
IUPAC NAME: 5-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine
SYSTEMATIC NAME: 5-[2-[2,6-bis(fluoranyl)phenyl]-4-phenyl-1H-imidazol-5-yl]-3-(2-methylpropyl)imidazo[4,5-b]pyridine
MOLECULAR FORMULA: C25H21F2N5
MOLECULAR WEIGHT: 429.464546
SMILES: CC(C)CN1C=NC2=C1N=C(C=C2)C3=C(N=C(N3)C4=C(C=CC=C4F)F)C5=CC=CC=C5
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Product OPENEYE NAME: 4-[3-[1-benzhydryl-5-chloro-2-[2-[[2-(trifluoromethoxy)phenyl]sulfonylamino]ethyl]indol-3-yl]propyl]benzoic acid
CAS Name: 4-[3-[5-chloro-1-(diphenylmethyl)-2-[2-[[2-(trifluoromethoxy)phenyl]sulfonylamino]ethyl]-3-indolyl]propyl]benzoic acid
IUPAC NAME: 4-[3-[1-benzhydryl-5-chloro-2-[2-[[2-(trifluoromethoxy)phenyl]sulfonylamino]ethyl]indol-3-yl]propyl]benzoic acid
SYSTEMATIC NAME: 4-[3-[5-chloranyl-1-(diphenylmethyl)-2-[2-[[2-(trifluoromethyloxy)phenyl]sulfonylamino]ethyl]indol-3-yl]propyl]benzoic acid
MOLECULAR FORMULA: C40H34ClF3N2O5S
MOLECULAR WEIGHT: 747.22157
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)N3C4=C(C=C(C=C4)Cl)C(=C3CCNS(=O)(=O)C5=CC=CC=C5OC(F)(F)F)CCCC6=CC=C(C=C6)C(=O)O
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Product OPENEYE NAME: 4-(4-methoxy-3-nitro-phenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
CAS Name: 4-(4-methoxy-3-nitrophenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
IUPAC NAME: 4-(4-methoxy-3-nitrophenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 4-(4-methoxy-3-nitro-phenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C19H19N3O7
MOLECULAR WEIGHT: 401.37006
SMILES: COC1=C(C=C(C=C1)C2=CNC(=O)N2C3=CC(=C(C(=C3)OC)OC)OC)[N+](=O)[O-]
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Product OPENEYE NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(3-furyl)-6a,10b-dimethyl-4,10-dioxo-9-propoxy-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
CAS Name: (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(3-furanyl)-6a,10b-dimethyl-4,10-dioxo-9-propoxy-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f][2]benzopyran-7-carboxylic acid methyl ester
IUPAC NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-6a,10b-dimethyl-4,10-dioxo-9-propoxy-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
SYSTEMATIC NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-6a,10b-dimethyl-4,10-bis(oxidanylidene)-9-propoxy-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
MOLECULAR FORMULA: C24H32O7
MOLECULAR WEIGHT: 432.50668
SMILES: CCCO[C@H]1C[C@H]([C@@]2(CC[C@H]3C(=O)O[C@@H](C[C@@]3([C@H]2C1=O)C)C4=COC=C4)C)C(=O)OC
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Product OPENEYE NAME: 4-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
CAS Name: 4-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
IUPAC NAME: 4-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 4-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C19H20N2O5
MOLECULAR WEIGHT: 356.3725
SMILES: COC1=CC=C(C=C1)C2=CNC(=O)N2C3=CC(=C(C(=C3)OC)OC)OC
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Product OPENEYE NAME: 4-(3,4-dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
CAS Name: 4-(3,4-dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
IUPAC NAME: 4-(3,4-dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 4-(3,4-dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C20H22N2O6
MOLECULAR WEIGHT: 386.39848
SMILES: COC1=C(C=C(C=C1)C2=CNC(=O)N2C3=CC(=C(C(=C3)OC)OC)OC)OC
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Product OPENEYE NAME: 2-(3,4-dimethoxyphenyl)-5-(imidazol-1-ylmethyl)pyridine
CAS Name: 2-(3,4-dimethoxyphenyl)-5-(1-imidazolylmethyl)pyridine
IUPAC NAME: 2-(3,4-dimethoxyphenyl)-5-(imidazol-1-ylmethyl)pyridine
SYSTEMATIC NAME: 2-(3,4-dimethoxyphenyl)-5-(imidazol-1-ylmethyl)pyridine
MOLECULAR FORMULA: C17H17N3O2
MOLECULAR WEIGHT: 295.33578
SMILES: COC1=C(C=C(C=C1)C2=NC=C(C=C2)CN3C=CN=C3)OC
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Product OPENEYE NAME: 3-[2-[(4-bromophenyl)methyl]-6-methyl-benzimidazol-1-yl]-N,N-dimethyl-propan-1-amine
CAS Name: 3-[2-[(4-bromophenyl)methyl]-6-methyl-1-benzimidazolyl]-N,N-dimethyl-1-propanamine
IUPAC NAME: 3-[2-[(4-bromophenyl)methyl]-6-methylbenzimidazol-1-yl]-N,N-dimethylpropan-1-amine
SYSTEMATIC NAME: 3-[2-[(4-bromophenyl)methyl]-6-methyl-benzimidazol-1-yl]-N,N-dimethyl-propan-1-amine
MOLECULAR FORMULA: C20H24BrN3
MOLECULAR WEIGHT: 386.32866
SMILES: CC1=CC2=C(C=C1)N=C(N2CCCN(C)C)CC3=CC=C(C=C3)Br
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Product OPENEYE NAME: (3R,6R)-1-[(1R)-2-(azetidin-1-yl)-1-(2-methyloxazol-4-yl)-2-oxo-ethyl]-3-indan-2-yl-6-isobutyl-piperazine-2,5-dione
CAS Name: (3R,6R)-1-[(1R)-2-(1-azetidinyl)-1-(2-methyl-4-oxazolyl)-2-oxoethyl]-3-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylpropyl)piperazine-2,5-dione
IUPAC NAME: (3R,6R)-1-[(1R)-2-(azetidin-1-yl)-1-(2-methyl-1,3-oxazol-4-yl)-2-oxoethyl]-3-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylpropyl)piperazine-2,5-dione
SYSTEMATIC NAME: (3R,6R)-1-[(1R)-2-(azetidin-1-yl)-1-(2-methyl-1,3-oxazol-4-yl)-2-oxidanylidene-ethyl]-3-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylpropyl)piperazine-2,5-dione
MOLECULAR FORMULA: C26H32N4O4
MOLECULAR WEIGHT: 464.55668
SMILES: CC1=NC(=CO1)[C@H](C(=O)N2CCC2)N3[C@@H](C(=O)N[C@@H](C3=O)C4CC5=CC=CC=C5C4)CC(C)C
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Product OPENEYE NAME: 5,8-dichloro-N-(2,2-difluoroethyl)-4-methyl-1,4-dihydroquinazolin-2-amine
CAS Name: 5,8-dichloro-N-(2,2-difluoroethyl)-4-methyl-1,4-dihydroquinazolin-2-amine
IUPAC NAME: 5,8-dichloro-N-(2,2-difluoroethyl)-4-methyl-1,4-dihydroquinazolin-2-amine
SYSTEMATIC NAME: N-[2,2-bis(fluoranyl)ethyl]-5,8-bis(chloranyl)-4-methyl-1,4-dihydroquinazolin-2-amine
MOLECULAR FORMULA: C11H11Cl2F2N3
MOLECULAR WEIGHT: 294.127946
SMILES: CC1C2=C(C=CC(=C2NC(=N1)NCC(F)F)Cl)Cl
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Product OPENEYE NAME: (2R)-N-tert-butyl-2-(3-furyl)-2-[(2R,5R)-5-indan-2-yl-2-isobutyl-3,6-dioxo-piperazin-1-yl]acetamide
CAS Name: (2R)-N-tert-butyl-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-dioxo-1-piperazinyl]-2-(3-furanyl)acetamide
IUPAC NAME: (2R)-N-tert-butyl-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-dioxopiperazin-1-yl]-2-(furan-3-yl)acetamide
SYSTEMATIC NAME: (2R)-N-tert-butyl-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-bis(oxidanylidene)piperazin-1-yl]-2-(furan-3-yl)ethanamide
MOLECULAR FORMULA: C27H35N3O4
MOLECULAR WEIGHT: 465.5845
SMILES: CC(C)C[C@@H]1C(=O)N[C@@H](C(=O)N1[C@H](C2=COC=C2)C(=O)NC(C)(C)C)C3CC4=CC=CC=C4C3
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C43H46N4O10
MOLECULAR WEIGHT: 778.84614
SMILES: CCC1=C(C2=CC3=NC(=CC4=C(C(=C(N4)C(=C5C(=C(C(=N5)C=C1N2)C)C(=O)OC)CC(=O)OC)CCC(=O)OC)C)[C@]6(C3=CC=C([C@H]6C(=O)OC)C(=O)OC)C)C
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Product OPENEYE NAME: 4-[2-[4-[(3-methoxyphenyl)-(2-thienyl)methyl]phenoxy]ethyl]morpholine
CAS Name: 4-[2-[4-[(3-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]morpholine
IUPAC NAME: 4-[2-[4-[(3-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]morpholine
SYSTEMATIC NAME: 4-[2-[4-[(3-methoxyphenyl)-thiophen-2-yl-methyl]phenoxy]ethyl]morpholine
MOLECULAR FORMULA: C24H27NO3S
MOLECULAR WEIGHT: 409.54108
SMILES: COC1=CC=CC(=C1)C(C2=CC=C(C=C2)OCCN3CCOCC3)C4=CC=CS4
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Product OPENEYE NAME: 2-[4-[(3-methoxyphenyl)-(2-thienyl)methyl]phenoxy]-N,N-dimethyl-ethanamine
CAS Name: 2-[4-[(3-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]-N,N-dimethylethanamine
IUPAC NAME: 2-[4-[(3-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]-N,N-dimethylethanamine
SYSTEMATIC NAME: 2-[4-[(3-methoxyphenyl)-thiophen-2-yl-methyl]phenoxy]-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C22H25NO2S
MOLECULAR WEIGHT: 367.5044
SMILES: CN(C)CCOC1=CC=C(C=C1)C(C2=CC(=CC=C2)OC)C3=CC=CS3
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