Thursday, March 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME: [(1R)-1-(benzimidazol-1-ylmethyl)-2-phenoxy-ethyl] acetate
CAS Name: acetic acid [(2R)-1-(1-benzimidazolyl)-3-phenoxypropan-2-yl] ester
IUPAC NAME: [(2R)-1-(benzimidazol-1-yl)-3-phenoxypropan-2-yl] acetate
SYSTEMATIC NAME: [(2R)-1-(benzimidazol-1-yl)-3-phenoxy-propan-2-yl] ethanoate
MOLECULAR FORMULA: C18H18N2O3
MOLECULAR WEIGHT: 310.34712
SMILES: CC(=O)O[C@H](CN1C=NC2=CC=CC=C21)COC3=CC=CC=C3
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Product OPENEYE NAME: [(1S)-1-(benzimidazol-1-ylmethyl)-2-benzyloxy-ethyl] acetate
CAS Name: acetic acid [(2S)-1-(1-benzimidazolyl)-3-phenylmethoxypropan-2-yl] ester
IUPAC NAME: [(2S)-1-(benzimidazol-1-yl)-3-phenylmethoxypropan-2-yl] acetate
SYSTEMATIC NAME: [(2S)-1-(benzimidazol-1-yl)-3-phenylmethoxy-propan-2-yl] ethanoate
MOLECULAR FORMULA: C19H20N2O3
MOLECULAR WEIGHT: 324.3737
SMILES: CC(=O)O[C@@H](CN1C=NC2=CC=CC=C21)COCC3=CC=CC=C3
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Product OPENEYE NAME: [(1R)-1-(benzimidazol-1-ylmethyl)-2-benzyloxy-ethyl] acetate
CAS Name: acetic acid [(2R)-1-(1-benzimidazolyl)-3-phenylmethoxypropan-2-yl] ester
IUPAC NAME: [(2R)-1-(benzimidazol-1-yl)-3-phenylmethoxypropan-2-yl] acetate
SYSTEMATIC NAME: [(2R)-1-(benzimidazol-1-yl)-3-phenylmethoxy-propan-2-yl] ethanoate
MOLECULAR FORMULA: C19H20N2O3
MOLECULAR WEIGHT: 324.3737
SMILES: CC(=O)O[C@H](CN1C=NC2=CC=CC=C21)COCC3=CC=CC=C3
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Product OPENEYE NAME: [(1S)-1-(benzimidazol-1-ylmethyl)-2-(3-methoxyphenoxy)ethyl] acetate
CAS Name: acetic acid [(2S)-1-(1-benzimidazolyl)-3-(3-methoxyphenoxy)propan-2-yl] ester
IUPAC NAME: [(2S)-1-(benzimidazol-1-yl)-3-(3-methoxyphenoxy)propan-2-yl] acetate
SYSTEMATIC NAME: [(2S)-1-(benzimidazol-1-yl)-3-(3-methoxyphenoxy)propan-2-yl] ethanoate
MOLECULAR FORMULA: C19H20N2O4
MOLECULAR WEIGHT: 340.3731
SMILES: CC(=O)O[C@@H](CN1C=NC2=CC=CC=C21)COC3=CC=CC(=C3)OC
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Product OPENEYE NAME: [(1R)-1-(benzimidazol-1-ylmethyl)-2-(3-methoxyphenoxy)ethyl] acetate
CAS Name: acetic acid [(2R)-1-(1-benzimidazolyl)-3-(3-methoxyphenoxy)propan-2-yl] ester
IUPAC NAME: [(2R)-1-(benzimidazol-1-yl)-3-(3-methoxyphenoxy)propan-2-yl] acetate
SYSTEMATIC NAME: [(2R)-1-(benzimidazol-1-yl)-3-(3-methoxyphenoxy)propan-2-yl] ethanoate
MOLECULAR FORMULA: C19H20N2O4
MOLECULAR WEIGHT: 340.3731
SMILES: CC(=O)O[C@H](CN1C=NC2=CC=CC=C21)COC3=CC=CC(=C3)OC
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Product OPENEYE NAME: (2R)-1-(2-isopropylbenzimidazol-1-yl)-3-(3-methylphenoxy)propan-2-ol
CAS Name: (2R)-1-(3-methylphenoxy)-3-(2-propan-2-yl-1-benzimidazolyl)-2-propanol
IUPAC NAME: (2R)-1-(3-methylphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
SYSTEMATIC NAME: (2R)-1-(3-methylphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
MOLECULAR FORMULA: C20H24N2O2
MOLECULAR WEIGHT: 324.41676
SMILES: CC1=CC(=CC=C1)OC[C@@H](CN2C3=CC=CC=C3N=C2C(C)C)O
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Product OPENEYE NAME: (2S)-1-(2-isopropylbenzimidazol-1-yl)-3-(3-methylphenoxy)propan-2-ol
CAS Name: (2S)-1-(3-methylphenoxy)-3-(2-propan-2-yl-1-benzimidazolyl)-2-propanol
IUPAC NAME: (2S)-1-(3-methylphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
SYSTEMATIC NAME: (2S)-1-(3-methylphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
MOLECULAR FORMULA: C20H24N2O2
MOLECULAR WEIGHT: 324.41676
SMILES: CC1=CC(=CC=C1)OC[C@H](CN2C3=CC=CC=C3N=C2C(C)C)O
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Product OPENEYE NAME: (2S)-1-(4-fluorophenoxy)-3-(2-isopropylbenzimidazol-1-yl)propan-2-ol
CAS Name: (2S)-1-(4-fluorophenoxy)-3-(2-propan-2-yl-1-benzimidazolyl)-2-propanol
IUPAC NAME: (2S)-1-(4-fluorophenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
SYSTEMATIC NAME: (2S)-1-(4-fluoranylphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
MOLECULAR FORMULA: C19H21FN2O2
MOLECULAR WEIGHT: 328.380643
SMILES: CC(C)C1=NC2=CC=CC=C2N1C[C@@H](COC3=CC=C(C=C3)F)O
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Product OPENEYE NAME: (2R)-1-(4-fluorophenoxy)-3-(2-isopropylbenzimidazol-1-yl)propan-2-ol
CAS Name: (2R)-1-(4-fluorophenoxy)-3-(2-propan-2-yl-1-benzimidazolyl)-2-propanol
IUPAC NAME: (2R)-1-(4-fluorophenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
SYSTEMATIC NAME: (2R)-1-(4-fluoranylphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
MOLECULAR FORMULA: C19H21FN2O2
MOLECULAR WEIGHT: 328.380643
SMILES: CC(C)C1=NC2=CC=CC=C2N1C[C@H](COC3=CC=C(C=C3)F)O
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Product OPENEYE NAME: (2S)-1-(2-isopropylbenzimidazol-1-yl)-3-(4-methoxyphenoxy)propan-2-ol
CAS Name: (2S)-1-(4-methoxyphenoxy)-3-(2-propan-2-yl-1-benzimidazolyl)-2-propanol
IUPAC NAME: (2S)-1-(4-methoxyphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
SYSTEMATIC NAME: (2S)-1-(4-methoxyphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
MOLECULAR FORMULA: C20H24N2O3
MOLECULAR WEIGHT: 340.41616
SMILES: CC(C)C1=NC2=CC=CC=C2N1C[C@@H](COC3=CC=C(C=C3)OC)O
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Product OPENEYE NAME: (2R)-1-(2-isopropylbenzimidazol-1-yl)-3-(4-methoxyphenoxy)propan-2-ol
CAS Name: (2R)-1-(4-methoxyphenoxy)-3-(2-propan-2-yl-1-benzimidazolyl)-2-propanol
IUPAC NAME: (2R)-1-(4-methoxyphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
SYSTEMATIC NAME: (2R)-1-(4-methoxyphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
MOLECULAR FORMULA: C20H24N2O3
MOLECULAR WEIGHT: 340.41616
SMILES: CC(C)C1=NC2=CC=CC=C2N1C[C@H](COC3=CC=C(C=C3)OC)O
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Product OPENEYE NAME: [(1R)-1-methyl-2-morpholino-ethyl] 2,2-diphenylpropanoate
CAS Name: 2,2-diphenylpropanoic acid [(2R)-1-(4-morpholinyl)propan-2-yl] ester
IUPAC NAME: [(2R)-1-morpholin-4-ylpropan-2-yl] 2,2-diphenylpropanoate
SYSTEMATIC NAME: [(2R)-1-morpholin-4-ylpropan-2-yl] 2,2-diphenylpropanoate
MOLECULAR FORMULA: C22H27NO3
MOLECULAR WEIGHT: 353.45468
SMILES: C[C@H](CN1CCOCC1)OC(=O)C(C)(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: [(1S)-1-methyl-2-morpholino-ethyl] 2,2-diphenylpropanoate
CAS Name: 2,2-diphenylpropanoic acid [(2S)-1-(4-morpholinyl)propan-2-yl] ester
IUPAC NAME: [(2S)-1-morpholin-4-ylpropan-2-yl] 2,2-diphenylpropanoate
SYSTEMATIC NAME: [(2S)-1-morpholin-4-ylpropan-2-yl] 2,2-diphenylpropanoate
MOLECULAR FORMULA: C22H27NO3
MOLECULAR WEIGHT: 353.45468
SMILES: C[C@@H](CN1CCOCC1)OC(=O)C(C)(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: 2-pyridyl 2-(4-methylphenoxy)acetate
CAS Name: 2-(4-methylphenoxy)acetic acid 2-pyridinyl ester
IUPAC NAME: pyridin-2-yl 2-(4-methylphenoxy)acetate
SYSTEMATIC NAME: pyridin-2-yl 2-(4-methylphenoxy)ethanoate
MOLECULAR FORMULA: C14H13NO3
MOLECULAR WEIGHT: 243.25792
SMILES: CC1=CC=C(C=C1)OCC(=O)OC2=CC=CC=N2
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Product OPENEYE NAME: [(1R)-1-methyl-2-(1-piperidyl)ethyl] 2-(4-methylphenoxy)acetate
CAS Name: 2-(4-methylphenoxy)acetic acid [(2R)-1-(1-piperidinyl)propan-2-yl] ester
IUPAC NAME: [(2R)-1-piperidin-1-ylpropan-2-yl] 2-(4-methylphenoxy)acetate
SYSTEMATIC NAME: [(2R)-1-piperidin-1-ylpropan-2-yl] 2-(4-methylphenoxy)ethanoate
MOLECULAR FORMULA: C17H25NO3
MOLECULAR WEIGHT: 291.3853
SMILES: CC1=CC=C(C=C1)OCC(=O)O[C@H](C)CN2CCCCC2
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Product OPENEYE NAME: [(1S)-1-methyl-2-(1-piperidyl)ethyl] 2-(4-methylphenoxy)acetate
CAS Name: 2-(4-methylphenoxy)acetic acid [(2S)-1-(1-piperidinyl)propan-2-yl] ester
IUPAC NAME: [(2S)-1-piperidin-1-ylpropan-2-yl] 2-(4-methylphenoxy)acetate
SYSTEMATIC NAME: [(2S)-1-piperidin-1-ylpropan-2-yl] 2-(4-methylphenoxy)ethanoate
MOLECULAR FORMULA: C17H25NO3
MOLECULAR WEIGHT: 291.3853
SMILES: CC1=CC=C(C=C1)OCC(=O)O[C@@H](C)CN2CCCCC2
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Product OPENEYE NAME: [(1R)-1-methyl-2-(1-piperidyl)ethyl] 2-(4-bromophenoxy)acetate
CAS Name: 2-(4-bromophenoxy)acetic acid [(2R)-1-(1-piperidinyl)propan-2-yl] ester
IUPAC NAME: [(2R)-1-piperidin-1-ylpropan-2-yl] 2-(4-bromophenoxy)acetate
SYSTEMATIC NAME: [(2R)-1-piperidin-1-ylpropan-2-yl] 2-(4-bromanylphenoxy)ethanoate
MOLECULAR FORMULA: C16H22BrNO3
MOLECULAR WEIGHT: 356.25478
SMILES: C[C@H](CN1CCCCC1)OC(=O)COC2=CC=C(C=C2)Br
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Product OPENEYE NAME: [(1S)-1-methyl-2-(1-piperidyl)ethyl] 2-(4-bromophenoxy)acetate
CAS Name: 2-(4-bromophenoxy)acetic acid [(2S)-1-(1-piperidinyl)propan-2-yl] ester
IUPAC NAME: [(2S)-1-piperidin-1-ylpropan-2-yl] 2-(4-bromophenoxy)acetate
SYSTEMATIC NAME: [(2S)-1-piperidin-1-ylpropan-2-yl] 2-(4-bromanylphenoxy)ethanoate
MOLECULAR FORMULA: C16H22BrNO3
MOLECULAR WEIGHT: 356.25478
SMILES: C[C@@H](CN1CCCCC1)OC(=O)COC2=CC=C(C=C2)Br
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Product OPENEYE NAME: [(1S)-1-methyl-2-morpholino-ethyl] 4-tert-butylbenzoate
CAS Name: 4-tert-butylbenzoic acid [(2S)-1-(4-morpholinyl)propan-2-yl] ester
IUPAC NAME: [(2S)-1-morpholin-4-ylpropan-2-yl] 4-tert-butylbenzoate
SYSTEMATIC NAME: [(2S)-1-morpholin-4-ylpropan-2-yl] 4-tert-butylbenzoate
MOLECULAR FORMULA: C18H27NO3
MOLECULAR WEIGHT: 305.41188
SMILES: C[C@@H](CN1CCOCC1)OC(=O)C2=CC=C(C=C2)C(C)(C)C
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Product OPENEYE NAME: [(1R)-1-methyl-2-morpholino-ethyl] 4-tert-butylbenzoate
CAS Name: 4-tert-butylbenzoic acid [(2R)-1-(4-morpholinyl)propan-2-yl] ester
IUPAC NAME: [(2R)-1-morpholin-4-ylpropan-2-yl] 4-tert-butylbenzoate
SYSTEMATIC NAME: [(2R)-1-morpholin-4-ylpropan-2-yl] 4-tert-butylbenzoate
MOLECULAR FORMULA: C18H27NO3
MOLECULAR WEIGHT: 305.41188
SMILES: C[C@H](CN1CCOCC1)OC(=O)C2=CC=C(C=C2)C(C)(C)C
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Product OPENEYE NAME: [(1R)-1-methyl-2-morpholino-ethyl] 2-methylbenzoate
CAS Name: 2-methylbenzoic acid [(2R)-1-(4-morpholinyl)propan-2-yl] ester
IUPAC NAME: [(2R)-1-morpholin-4-ylpropan-2-yl] 2-methylbenzoate
SYSTEMATIC NAME: [(2R)-1-morpholin-4-ylpropan-2-yl] 2-methylbenzoate
MOLECULAR FORMULA: C15H21NO3
MOLECULAR WEIGHT: 263.33214
SMILES: CC1=CC=CC=C1C(=O)O[C@H](C)CN2CCOCC2
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Product OPENEYE NAME: [(1S)-1-methyl-2-morpholino-ethyl] 2-methylbenzoate
CAS Name: 2-methylbenzoic acid [(2S)-1-(4-morpholinyl)propan-2-yl] ester
IUPAC NAME: [(2S)-1-morpholin-4-ylpropan-2-yl] 2-methylbenzoate
SYSTEMATIC NAME: [(2S)-1-morpholin-4-ylpropan-2-yl] 2-methylbenzoate
MOLECULAR FORMULA: C15H21NO3
MOLECULAR WEIGHT: 263.33214
SMILES: CC1=CC=CC=C1C(=O)O[C@@H](C)CN2CCOCC2
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Product OPENEYE NAME: N-[2-(2-morpholino-2-oxo-ethyl)sulfanyl-1,3-benzothiazol-6-yl]acetamide
CAS Name: N-[2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]acetamide
IUPAC NAME: N-[2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-1,3-benzothiazol-6-yl]acetamide
SYSTEMATIC NAME: N-[2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1,3-benzothiazol-6-yl]ethanamide
MOLECULAR FORMULA: C15H17N3O3S2
MOLECULAR WEIGHT: 351.44378
SMILES: CC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3CCOCC3
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