Sunday, January 6, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[(3S)-1-benzylpyrrolidin-3-yl]-6-fluoro-1H-benzimidazole
CAS Name: 6-fluoro-2-[(3S)-1-(phenylmethyl)-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 2-[(3S)-1-benzylpyrrolidin-3-yl]-6-fluoro-1H-benzimidazole
SYSTEMATIC NAME: 6-fluoranyl-2-[(3S)-1-(phenylmethyl)pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C18H18FN3
MOLECULAR WEIGHT: 295.354023
SMILES: C1CN(C[C@H]1C2=NC3=C(N2)C=C(C=C3)F)CC4=CC=CC=C4
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Product OPENEYE NAME: 4-[[(3S)-3-(6-fluoro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzoic acid
CAS Name: 4-[[(3S)-3-(6-fluoro-1H-benzimidazol-2-yl)-1-pyrrolidinyl]methyl]benzoic acid
IUPAC NAME: 4-[[(3S)-3-(6-fluoro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[(3S)-3-(6-fluoranyl-1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzoic acid
MOLECULAR FORMULA: C19H18FN3O2
MOLECULAR WEIGHT: 339.363523
SMILES: C1CN(C[C@H]1C2=NC3=C(N2)C=C(C=C3)F)CC4=CC=C(C=C4)C(=O)O
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Product OPENEYE NAME: 2-[(3S)-1-[(4-chlorophenyl)methyl]pyrrolidin-3-yl]-6-fluoro-1H-benzimidazole
CAS Name: 2-[(3S)-1-[(4-chlorophenyl)methyl]-3-pyrrolidinyl]-6-fluoro-1H-benzimidazole
IUPAC NAME: 2-[(3S)-1-[(4-chlorophenyl)methyl]pyrrolidin-3-yl]-6-fluoro-1H-benzimidazole
SYSTEMATIC NAME: 2-[(3S)-1-[(4-chlorophenyl)methyl]pyrrolidin-3-yl]-6-fluoranyl-1H-benzimidazole
MOLECULAR FORMULA: C18H17ClFN3
MOLECULAR WEIGHT: 329.799083
SMILES: C1CN(C[C@H]1C2=NC3=C(N2)C=C(C=C3)F)CC4=CC=C(C=C4)Cl
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Product OPENEYE NAME: 3-[[(3S)-3-(6-fluoro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzonitrile
CAS Name: 3-[[(3S)-3-(6-fluoro-1H-benzimidazol-2-yl)-1-pyrrolidinyl]methyl]benzonitrile
IUPAC NAME: 3-[[(3S)-3-(6-fluoro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 3-[[(3S)-3-(6-fluoranyl-1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C19H17FN4
MOLECULAR WEIGHT: 320.363483
SMILES: C1CN(C[C@H]1C2=NC3=C(N2)C=C(C=C3)F)CC4=CC=CC(=C4)C#N
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Product OPENEYE NAME: 2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-6-fluoro-1H-benzimidazole
CAS Name: 2-[(3S)-1-cyclobutyl-3-pyrrolidinyl]-6-fluoro-1H-benzimidazole
IUPAC NAME: 2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-6-fluoro-1H-benzimidazole
SYSTEMATIC NAME: 2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-6-fluoranyl-1H-benzimidazole
MOLECULAR FORMULA: C15H18FN3
MOLECULAR WEIGHT: 259.321923
SMILES: C1CC(C1)N2CC[C@@H](C2)C3=NC4=C(N3)C=C(C=C4)F
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Product OPENEYE NAME: 2-[(3S)-1-[(3,4-difluorophenyl)methyl]pyrrolidin-3-yl]-6-fluoro-1H-benzimidazole
CAS Name: 2-[(3S)-1-[(3,4-difluorophenyl)methyl]-3-pyrrolidinyl]-6-fluoro-1H-benzimidazole
IUPAC NAME: 2-[(3S)-1-[(3,4-difluorophenyl)methyl]pyrrolidin-3-yl]-6-fluoro-1H-benzimidazole
SYSTEMATIC NAME: 2-[(3S)-1-[[3,4-bis(fluoranyl)phenyl]methyl]pyrrolidin-3-yl]-6-fluoranyl-1H-benzimidazole
MOLECULAR FORMULA: C18H16F3N3
MOLECULAR WEIGHT: 331.33495
SMILES: C1CN(C[C@H]1C2=NC3=C(N2)C=C(C=C3)F)CC4=CC(=C(C=C4)F)F
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Product OPENEYE NAME: 6-fluoro-2-[(3S)-1-[(2-methoxyphenyl)methyl]pyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 6-fluoro-2-[(3S)-1-[(2-methoxyphenyl)methyl]-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 6-fluoro-2-[(3S)-1-[(2-methoxyphenyl)methyl]pyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 6-fluoranyl-2-[(3S)-1-[(2-methoxyphenyl)methyl]pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C19H20FN3O
MOLECULAR WEIGHT: 325.380003
SMILES: COC1=CC=CC=C1CN2CC[C@@H](C2)C3=NC4=C(N3)C=C(C=C4)F
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Product OPENEYE NAME: 6-fluoro-2-[(3S)-1-(1-methyl-4-piperidyl)pyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 6-fluoro-2-[(3S)-1-(1-methyl-4-piperidinyl)-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 6-fluoro-2-[(3S)-1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 6-fluoranyl-2-[(3S)-1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C17H23FN4
MOLECULAR WEIGHT: 302.389723
SMILES: CN1CCC(CC1)N2CC[C@@H](C2)C3=NC4=C(N3)C=C(C=C4)F
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Product OPENEYE NAME: 2-[(3S)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]-6-fluoro-1H-benzimidazole
CAS Name: 2-[(3S)-1-(1,3-benzodioxol-5-ylmethyl)-3-pyrrolidinyl]-6-fluoro-1H-benzimidazole
IUPAC NAME: 2-[(3S)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]-6-fluoro-1H-benzimidazole
SYSTEMATIC NAME: 2-[(3S)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]-6-fluoranyl-1H-benzimidazole
MOLECULAR FORMULA: C19H18FN3O2
MOLECULAR WEIGHT: 339.363523
SMILES: C1CN(C[C@H]1C2=NC3=C(N2)C=C(C=C3)F)CC4=CC5=C(C=C4)OCO5
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Product OPENEYE NAME: 6-fluoro-2-[(3S)-1-(2-pyridylmethyl)pyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 6-fluoro-2-[(3S)-1-(2-pyridinylmethyl)-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 6-fluoro-2-[(3S)-1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 6-fluoranyl-2-[(3S)-1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C17H17FN4
MOLECULAR WEIGHT: 296.342083
SMILES: C1CN(C[C@H]1C2=NC3=C(N2)C=C(C=C3)F)CC4=CC=CC=N4
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Product OPENEYE NAME: 6-fluoro-2-[(3S)-1-(3-pyridylmethyl)pyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 6-fluoro-2-[(3S)-1-(3-pyridinylmethyl)-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 6-fluoro-2-[(3S)-1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 6-fluoranyl-2-[(3S)-1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C17H17FN4
MOLECULAR WEIGHT: 296.342083
SMILES: C1CN(C[C@H]1C2=NC3=C(N2)C=C(C=C3)F)CC4=CN=CC=C4
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Product OPENEYE NAME: 6-fluoro-2-[(3S)-1-tetrahydropyran-4-ylpyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 6-fluoro-2-[(3S)-1-(4-oxanyl)-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 6-fluoro-2-[(3S)-1-(oxan-4-yl)pyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 6-fluoranyl-2-[(3S)-1-(oxan-4-yl)pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C16H20FN3O
MOLECULAR WEIGHT: 289.347903
SMILES: C1CN(C[C@H]1C2=NC3=C(N2)C=C(C=C3)F)C4CCOCC4
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Product OPENEYE NAME: 6-fluoro-2-[(3S)-1-(o-tolylmethyl)pyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 6-fluoro-2-[(3S)-1-[(2-methylphenyl)methyl]-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 6-fluoro-2-[(3S)-1-[(2-methylphenyl)methyl]pyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 6-fluoranyl-2-[(3S)-1-[(2-methylphenyl)methyl]pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C19H20FN3
MOLECULAR WEIGHT: 309.380603
SMILES: CC1=CC=CC=C1CN2CC[C@@H](C2)C3=NC4=C(N3)C=C(C=C4)F
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Product OPENEYE NAME: 6-fluoro-2-[(3S)-1-isopropylpyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 6-fluoro-2-[(3S)-1-propan-2-yl-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 6-fluoro-2-[(3S)-1-propan-2-ylpyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 6-fluoranyl-2-[(3S)-1-propan-2-ylpyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C14H18FN3
MOLECULAR WEIGHT: 247.311223
SMILES: CC(C)N1CC[C@@H](C1)C2=NC3=C(N2)C=C(C=C3)F
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Product OPENEYE NAME: 6-fluoro-2-[(3S)-1-[(1-methylindol-3-yl)methyl]pyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 6-fluoro-2-[(3S)-1-[(1-methyl-3-indolyl)methyl]-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 6-fluoro-2-[(3S)-1-[(1-methylindol-3-yl)methyl]pyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 6-fluoranyl-2-[(3S)-1-[(1-methylindol-3-yl)methyl]pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C21H21FN4
MOLECULAR WEIGHT: 348.416643
SMILES: CN1C=C(C2=CC=CC=C21)CN3CC[C@@H](C3)C4=NC5=C(N4)C=C(C=C5)F
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Product OPENEYE NAME: 6-fluoro-2-[(3S)-1-[[3-(trifluoromethoxy)phenyl]methyl]pyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 6-fluoro-2-[(3S)-1-[[3-(trifluoromethoxy)phenyl]methyl]-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 6-fluoro-2-[(3S)-1-[[3-(trifluoromethoxy)phenyl]methyl]pyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 6-fluoranyl-2-[(3S)-1-[[3-(trifluoromethyloxy)phenyl]methyl]pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C19H17F4N3O
MOLECULAR WEIGHT: 379.351393
SMILES: C1CN(C[C@H]1C2=NC3=C(N2)C=C(C=C3)F)CC4=CC(=CC=C4)OC(F)(F)F
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Product OPENEYE NAME: 1-[4-[(3S)-3-(6-fluoro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]-1-piperidyl]ethanone
CAS Name: 1-[4-[(3S)-3-(6-fluoro-1H-benzimidazol-2-yl)-1-pyrrolidinyl]-1-piperidinyl]ethanone
IUPAC NAME: 1-[4-[(3S)-3-(6-fluoro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]piperidin-1-yl]ethanone
SYSTEMATIC NAME: 1-[4-[(3S)-3-(6-fluoranyl-1H-benzimidazol-2-yl)pyrrolidin-1-yl]piperidin-1-yl]ethanone
MOLECULAR FORMULA: C18H23FN4O
MOLECULAR WEIGHT: 330.399823
SMILES: CC(=O)N1CCC(CC1)N2CC[C@@H](C2)C3=NC4=C(N3)C=C(C=C4)F
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Product OPENEYE NAME: 6-fluoro-2-[(3S)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 6-fluoro-2-[(3S)-1-[(4-methylsulfonylphenyl)methyl]-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 6-fluoro-2-[(3S)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 6-fluoranyl-2-[(3S)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C19H20FN3O2S
MOLECULAR WEIGHT: 373.444403
SMILES: CS(=O)(=O)C1=CC=C(C=C1)CN2CC[C@@H](C2)C3=NC4=C(N3)C=C(C=C4)F
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Product OPENEYE NAME: 4-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzoic acid
CAS Name: 4-[[(3S)-3-(1H-benzimidazol-2-yl)-1-pyrrolidinyl]methyl]benzoic acid
IUPAC NAME: 4-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzoic acid
MOLECULAR FORMULA: C19H19N3O2
MOLECULAR WEIGHT: 321.37306
SMILES: C1CN(C[C@H]1C2=NC3=CC=CC=C3N2)CC4=CC=C(C=C4)C(=O)O
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Product OPENEYE NAME: 3-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzonitrile
CAS Name: 3-[[(3S)-3-(1H-benzimidazol-2-yl)-1-pyrrolidinyl]methyl]benzonitrile
IUPAC NAME: 3-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 3-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C19H18N4
MOLECULAR WEIGHT: 302.37302
SMILES: C1CN(C[C@H]1C2=NC3=CC=CC=C3N2)CC4=CC=CC(=C4)C#N
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Product OPENEYE NAME: [5-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]-2-furyl]methanol
CAS Name: [5-[[(3S)-3-(1H-benzimidazol-2-yl)-1-pyrrolidinyl]methyl]-2-furanyl]methanol
IUPAC NAME: [5-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]furan-2-yl]methanol
SYSTEMATIC NAME: [5-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]furan-2-yl]methanol
MOLECULAR FORMULA: C17H19N3O2
MOLECULAR WEIGHT: 297.35166
SMILES: C1CN(C[C@H]1C2=NC3=CC=CC=C3N2)CC4=CC=C(O4)CO
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Product OPENEYE NAME: 2-[(3S)-1-(3-phenylpropyl)pyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 2-[(3S)-1-(3-phenylpropyl)-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 2-[(3S)-1-(3-phenylpropyl)pyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 2-[(3S)-1-(3-phenylpropyl)pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C20H23N3
MOLECULAR WEIGHT: 305.41672
SMILES: C1CN(C[C@H]1C2=NC3=CC=CC=C3N2)CCCC4=CC=CC=C4
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Product OPENEYE NAME: 2-[(3S)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]-1H-benzimidazole
CAS Name: 2-[(3S)-1-(1,3-benzodioxol-5-ylmethyl)-3-pyrrolidinyl]-1H-benzimidazole
IUPAC NAME: 2-[(3S)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]-1H-benzimidazole
SYSTEMATIC NAME: 2-[(3S)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]-1H-benzimidazole
MOLECULAR FORMULA: C19H19N3O2
MOLECULAR WEIGHT: 321.37306
SMILES: C1CN(C[C@H]1C2=NC3=CC=CC=C3N2)CC4=CC5=C(C=C4)OCO5
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Product OPENEYE NAME: N-[4-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]phenyl]acetamide
CAS Name: N-[4-[[(3S)-3-(1H-benzimidazol-2-yl)-1-pyrrolidinyl]methyl]phenyl]acetamide
IUPAC NAME: N-[4-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]phenyl]ethanamide
MOLECULAR FORMULA: C20H22N4O
MOLECULAR WEIGHT: 334.41488
SMILES: CC(=O)NC1=CC=C(C=C1)CN2CC[C@@H](C2)C3=NC4=CC=CC=C4N3
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