Sunday, January 6, 2013

All Chemical Compounds Information



Product OPENEYE NAME: 4-[[(3S)-3-(5-chloro-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]methyl]-N,N-dimethyl-aniline
CAS Name: 4-[[(3S)-3-(5-chloro-1,3-benzoxazol-2-yl)-1-pyrrolidinyl]methyl]-N,N-dimethylaniline
IUPAC NAME: 4-[[(3S)-3-(5-chloro-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]methyl]-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[[(3S)-3-(5-chloranyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]methyl]-N,N-dimethyl-aniline
MOLECULAR FORMULA: C20H22ClN3O
MOLECULAR WEIGHT: 355.86118
SMILES: CN(C)C1=CC=C(C=C1)CN2CC[C@@H](C2)C3=NC4=C(O3)C=CC(=C4)Cl
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Product OPENEYE NAME: 5-chloro-2-[(3S)-1-[(2-fluorophenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole
CAS Name: 5-chloro-2-[(3S)-1-[(2-fluorophenyl)methyl]-3-pyrrolidinyl]-1,3-benzoxazole
IUPAC NAME: 5-chloro-2-[(3S)-1-[(2-fluorophenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole
SYSTEMATIC NAME: 5-chloranyl-2-[(3S)-1-[(2-fluorophenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole
MOLECULAR FORMULA: C18H16ClFN2O
MOLECULAR WEIGHT: 330.783843
SMILES: C1CN(C[C@H]1C2=NC3=C(O2)C=CC(=C3)Cl)CC4=CC=CC=C4F
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Product OPENEYE NAME: 5-chloro-2-[(3S)-1-[(4-fluorophenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole
CAS Name: 5-chloro-2-[(3S)-1-[(4-fluorophenyl)methyl]-3-pyrrolidinyl]-1,3-benzoxazole
IUPAC NAME: 5-chloro-2-[(3S)-1-[(4-fluorophenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole
SYSTEMATIC NAME: 5-chloranyl-2-[(3S)-1-[(4-fluorophenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole
MOLECULAR FORMULA: C18H16ClFN2O
MOLECULAR WEIGHT: 330.783843
SMILES: C1CN(C[C@H]1C2=NC3=C(O2)C=CC(=C3)Cl)CC4=CC=C(C=C4)F
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Product OPENEYE NAME: 5-chloro-2-[(3S)-1-methylpyrrolidin-3-yl]-1,3-benzoxazole
CAS Name: 5-chloro-2-[(3S)-1-methyl-3-pyrrolidinyl]-1,3-benzoxazole
IUPAC NAME: 5-chloro-2-[(3S)-1-methylpyrrolidin-3-yl]-1,3-benzoxazole
SYSTEMATIC NAME: 5-chloranyl-2-[(3S)-1-methylpyrrolidin-3-yl]-1,3-benzoxazole
MOLECULAR FORMULA: C12H13ClN2O
MOLECULAR WEIGHT: 236.69742
SMILES: CN1CC[C@@H](C1)C2=NC3=C(O2)C=CC(=C3)Cl
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Product OPENEYE NAME: 5-chloro-2-[(3S)-1-[(3-methoxyphenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole
CAS Name: 5-chloro-2-[(3S)-1-[(3-methoxyphenyl)methyl]-3-pyrrolidinyl]-1,3-benzoxazole
IUPAC NAME: 5-chloro-2-[(3S)-1-[(3-methoxyphenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole
SYSTEMATIC NAME: 5-chloranyl-2-[(3S)-1-[(3-methoxyphenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole
MOLECULAR FORMULA: C19H19ClN2O2
MOLECULAR WEIGHT: 342.81936
SMILES: COC1=CC=CC(=C1)CN2CC[C@@H](C2)C3=NC4=C(O3)C=CC(=C4)Cl
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Product OPENEYE NAME: 5-chloro-2-[(3S)-1-(2-pyridylmethyl)pyrrolidin-3-yl]-1,3-benzoxazole
CAS Name: 5-chloro-2-[(3S)-1-(2-pyridinylmethyl)-3-pyrrolidinyl]-1,3-benzoxazole
IUPAC NAME: 5-chloro-2-[(3S)-1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]-1,3-benzoxazole
SYSTEMATIC NAME: 5-chloranyl-2-[(3S)-1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]-1,3-benzoxazole
MOLECULAR FORMULA: C17H16ClN3O
MOLECULAR WEIGHT: 313.78144
SMILES: C1CN(C[C@H]1C2=NC3=C(O2)C=CC(=C3)Cl)CC4=CC=CC=N4
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Product OPENEYE NAME: 5-chloro-2-[(3S)-1-(2-thienylmethyl)pyrrolidin-3-yl]-1,3-benzoxazole
CAS Name: 5-chloro-2-[(3S)-1-(thiophen-2-ylmethyl)-3-pyrrolidinyl]-1,3-benzoxazole
IUPAC NAME: 5-chloro-2-[(3S)-1-(thiophen-2-ylmethyl)pyrrolidin-3-yl]-1,3-benzoxazole
SYSTEMATIC NAME: 5-chloranyl-2-[(3S)-1-(thiophen-2-ylmethyl)pyrrolidin-3-yl]-1,3-benzoxazole
MOLECULAR FORMULA: C16H15ClN2OS
MOLECULAR WEIGHT: 318.8211
SMILES: C1CN(C[C@H]1C2=NC3=C(O2)C=CC(=C3)Cl)CC4=CC=CS4
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Product OPENEYE NAME: 5-chloro-2-[(3S)-1-(o-tolylmethyl)pyrrolidin-3-yl]-1,3-benzoxazole
CAS Name: 5-chloro-2-[(3S)-1-[(2-methylphenyl)methyl]-3-pyrrolidinyl]-1,3-benzoxazole
IUPAC NAME: 5-chloro-2-[(3S)-1-[(2-methylphenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole
SYSTEMATIC NAME: 5-chloranyl-2-[(3S)-1-[(2-methylphenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole
MOLECULAR FORMULA: C19H19ClN2O
MOLECULAR WEIGHT: 326.81996
SMILES: CC1=CC=CC=C1CN2CC[C@@H](C2)C3=NC4=C(O3)C=CC(=C4)Cl
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Product OPENEYE NAME: 1-[4-[(3S)-3-(5-chloro-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]-1-piperidyl]ethanone
CAS Name: 1-[4-[(3S)-3-(5-chloro-1,3-benzoxazol-2-yl)-1-pyrrolidinyl]-1-piperidinyl]ethanone
IUPAC NAME: 1-[4-[(3S)-3-(5-chloro-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]piperidin-1-yl]ethanone
SYSTEMATIC NAME: 1-[4-[(3S)-3-(5-chloranyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]piperidin-1-yl]ethanone
MOLECULAR FORMULA: C18H22ClN3O2
MOLECULAR WEIGHT: 347.83918
SMILES: CC(=O)N1CCC(CC1)N2CC[C@@H](C2)C3=NC4=C(O3)C=CC(=C4)Cl
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Product OPENEYE NAME: 2-[(3S)-1-benzylpyrrolidin-3-yl]-5-methyl-1,3-benzoxazole
CAS Name: 5-methyl-2-[(3S)-1-(phenylmethyl)-3-pyrrolidinyl]-1,3-benzoxazole
IUPAC NAME: 2-[(3S)-1-benzylpyrrolidin-3-yl]-5-methyl-1,3-benzoxazole
SYSTEMATIC NAME: 5-methyl-2-[(3S)-1-(phenylmethyl)pyrrolidin-3-yl]-1,3-benzoxazole
MOLECULAR FORMULA: C19H20N2O
MOLECULAR WEIGHT: 292.3749
SMILES: CC1=CC2=C(C=C1)OC(=N2)[C@H]3CCN(C3)CC4=CC=CC=C4
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Product OPENEYE NAME: 2-[(3S)-1-[(3-chlorophenyl)methyl]pyrrolidin-3-yl]-5-methyl-1,3-benzoxazole
CAS Name: 2-[(3S)-1-[(3-chlorophenyl)methyl]-3-pyrrolidinyl]-5-methyl-1,3-benzoxazole
IUPAC NAME: 2-[(3S)-1-[(3-chlorophenyl)methyl]pyrrolidin-3-yl]-5-methyl-1,3-benzoxazole
SYSTEMATIC NAME: 2-[(3S)-1-[(3-chlorophenyl)methyl]pyrrolidin-3-yl]-5-methyl-1,3-benzoxazole
MOLECULAR FORMULA: C19H19ClN2O
MOLECULAR WEIGHT: 326.81996
SMILES: CC1=CC2=C(C=C1)OC(=N2)[C@H]3CCN(C3)CC4=CC(=CC=C4)Cl
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Product OPENEYE NAME: 4-[[(3S)-3-(5-methyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]methyl]benzonitrile
CAS Name: 4-[[(3S)-3-(5-methyl-1,3-benzoxazol-2-yl)-1-pyrrolidinyl]methyl]benzonitrile
IUPAC NAME: 4-[[(3S)-3-(5-methyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 4-[[(3S)-3-(5-methyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C20H19N3O
MOLECULAR WEIGHT: 317.38436
SMILES: CC1=CC2=C(C=C1)OC(=N2)[C@H]3CCN(C3)CC4=CC=C(C=C4)C#N
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