Saturday, January 5, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 1-[4-[(2S)-2-[3-[6-(dimethylamino)-3-pyridyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-1-piperidyl]ethanone
CAS Name: 1-[4-[(2S)-2-[3-[6-(dimethylamino)-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]-1-piperidinyl]ethanone
IUPAC NAME: 1-[4-[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]piperidin-1-yl]ethanone
SYSTEMATIC NAME: 1-[4-[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]piperidin-1-yl]ethanone
MOLECULAR FORMULA: C20H28N6O2
MOLECULAR WEIGHT: 384.47532
SMILES: CC(=O)N1CCC(CC1)N2CCC[C@H]2C3=NC(=NO3)C4=CN=C(C=C4)N(C)C
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Product OPENEYE NAME: 5-[5-[(2S)-1-benzylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-(phenylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: 5-[5-[(2S)-1-benzylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylpyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-(phenylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C20H23N5O
MOLECULAR WEIGHT: 349.42952
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CC=C4
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Product OPENEYE NAME: 4-[[(2S)-2-[3-[6-(dimethylamino)-3-pyridyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzoic acid
CAS Name: 4-[[(2S)-2-[3-[6-(dimethylamino)-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]methyl]benzoic acid
IUPAC NAME: 4-[[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzoic acid
MOLECULAR FORMULA: C21H23N5O3
MOLECULAR WEIGHT: 393.43902
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=C(C=C4)C(=O)O
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Product OPENEYE NAME: 5-[5-[(2S)-1-[(4-chlorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
CAS Name: 5-[5-[(2S)-1-[(4-chlorophenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-2-pyridinamine
IUPAC NAME: 5-[5-[(2S)-1-[(4-chlorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylpyridin-2-amine
SYSTEMATIC NAME: 5-[5-[(2S)-1-[(4-chlorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
MOLECULAR FORMULA: C20H22ClN5O
MOLECULAR WEIGHT: 383.87458
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=C(C=C4)Cl
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Product OPENEYE NAME: 3-[[(2S)-2-[3-[6-(dimethylamino)-3-pyridyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzonitrile
CAS Name: 3-[[(2S)-2-[3-[6-(dimethylamino)-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]methyl]benzonitrile
IUPAC NAME: 3-[[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 3-[[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C21H22N6O
MOLECULAR WEIGHT: 374.43898
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CC(=C4)C#N
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Product OPENEYE NAME: 4-[[(2S)-2-[3-[6-(dimethylamino)-3-pyridyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzonitrile
CAS Name: 4-[[(2S)-2-[3-[6-(dimethylamino)-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]methyl]benzonitrile
IUPAC NAME: 4-[[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 4-[[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C21H22N6O
MOLECULAR WEIGHT: 374.43898
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=C(C=C4)C#N
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Product OPENEYE NAME: 5-[5-[(2S)-1-(cyclohexylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
CAS Name: 5-[5-[(2S)-1-(cyclohexylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-2-pyridinamine
IUPAC NAME: 5-[5-[(2S)-1-(cyclohexylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylpyridin-2-amine
SYSTEMATIC NAME: 5-[5-[(2S)-1-(cyclohexylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
MOLECULAR FORMULA: C20H29N5O
MOLECULAR WEIGHT: 355.47716
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4CCCCC4
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Product OPENEYE NAME: 5-[5-[(2S)-1-[(3,4-difluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
CAS Name: 5-[5-[(2S)-1-[(3,4-difluorophenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-2-pyridinamine
IUPAC NAME: 5-[5-[(2S)-1-[(3,4-difluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylpyridin-2-amine
SYSTEMATIC NAME: 5-[5-[(2S)-1-[[3,4-bis(fluoranyl)phenyl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
MOLECULAR FORMULA: C20H21F2N5O
MOLECULAR WEIGHT: 385.410446
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC(=C(C=C4)F)F
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Product OPENEYE NAME: 5-[5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
CAS Name: 5-[5-[(2S)-1-[(2-fluorophenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-2-pyridinamine
IUPAC NAME: 5-[5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylpyridin-2-amine
SYSTEMATIC NAME: 5-[5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
MOLECULAR FORMULA: C20H22FN5O
MOLECULAR WEIGHT: 367.419983
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CC=C4F
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Product OPENEYE NAME: 5-[5-[(2S)-1-[(4-fluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
CAS Name: 5-[5-[(2S)-1-[(4-fluorophenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-2-pyridinamine
IUPAC NAME: 5-[5-[(2S)-1-[(4-fluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylpyridin-2-amine
SYSTEMATIC NAME: 5-[5-[(2S)-1-[(4-fluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
MOLECULAR FORMULA: C20H22FN5O
MOLECULAR WEIGHT: 367.419983
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=C(C=C4)F
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Product OPENEYE NAME: N,N-dimethyl-5-[5-[(2S)-1-methylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-methyl-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-methylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-methylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C14H19N5O
MOLECULAR WEIGHT: 273.33356
SMILES: CN1CCC[C@H]1C2=NC(=NO2)C3=CN=C(C=C3)N(C)C
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