Friday, January 4, 2013

All Chemical Compounds Information



Product OPENEYE NAME: 3-[[(2S)-2-[3-[2-(2-methoxyethylamino)-3-pyridyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzonitrile
CAS Name: 3-[[(2S)-2-[3-[2-(2-methoxyethylamino)-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]methyl]benzonitrile
IUPAC NAME: 3-[[(2S)-2-[3-[2-(2-methoxyethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 3-[[(2S)-2-[3-[2-(2-methoxyethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C22H24N6O2
MOLECULAR WEIGHT: 404.46496
SMILES: COCCNC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CC(=C4)C#N
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Product OPENEYE NAME: 3-[5-[(2S)-1-(cyclohexylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
CAS Name: 3-[5-[(2S)-1-(cyclohexylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)-2-pyridinamine
IUPAC NAME: 3-[5-[(2S)-1-(cyclohexylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
SYSTEMATIC NAME: 3-[5-[(2S)-1-(cyclohexylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
MOLECULAR FORMULA: C21H31N5O2
MOLECULAR WEIGHT: 385.50314
SMILES: COCCNC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4CCCCC4
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Product OPENEYE NAME: 3-[5-[(2S)-1-cyclohexylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
CAS Name: 3-[5-[(2S)-1-cyclohexyl-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)-2-pyridinamine
IUPAC NAME: 3-[5-[(2S)-1-cyclohexylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
SYSTEMATIC NAME: 3-[5-[(2S)-1-cyclohexylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
MOLECULAR FORMULA: C20H29N5O2
MOLECULAR WEIGHT: 371.47656
SMILES: COCCNC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3C4CCCCC4
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Product OPENEYE NAME: 3-[5-[(2S)-1-[(3,4-difluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
CAS Name: 3-[5-[(2S)-1-[(3,4-difluorophenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)-2-pyridinamine
IUPAC NAME: 3-[5-[(2S)-1-[(3,4-difluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
SYSTEMATIC NAME: 3-[5-[(2S)-1-[[3,4-bis(fluoranyl)phenyl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
MOLECULAR FORMULA: C21H23F2N5O2
MOLECULAR WEIGHT: 415.436426
SMILES: COCCNC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC(=C(C=C4)F)F
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Product OPENEYE NAME: 3-[5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
CAS Name: 3-[5-[(2S)-1-[(2-fluorophenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)-2-pyridinamine
IUPAC NAME: 3-[5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
SYSTEMATIC NAME: 3-[5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
MOLECULAR FORMULA: C21H24FN5O2
MOLECULAR WEIGHT: 397.445963
SMILES: COCCNC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CC=C4F
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Product OPENEYE NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-methylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N-(2-methoxyethyl)-3-[5-[(2S)-1-methyl-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-methylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-methylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C15H21N5O2
MOLECULAR WEIGHT: 303.35954
SMILES: CN1CCC[C@H]1C2=NC(=NO2)C3=C(N=CC=C3)NCCOC
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Product OPENEYE NAME: 3-[5-[(2S)-1-(2-furylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
CAS Name: 3-[5-[(2S)-1-(2-furanylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)-2-pyridinamine
IUPAC NAME: 3-[5-[(2S)-1-(furan-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
SYSTEMATIC NAME: 3-[5-[(2S)-1-(furan-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
MOLECULAR FORMULA: C19H23N5O3
MOLECULAR WEIGHT: 369.41762
SMILES: COCCNC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CO4
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Product OPENEYE NAME: [5-[[(2S)-2-[3-[2-(2-methoxyethylamino)-3-pyridyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]-2-furyl]methanol
CAS Name: [5-[[(2S)-2-[3-[2-(2-methoxyethylamino)-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]methyl]-2-furanyl]methanol
IUPAC NAME: [5-[[(2S)-2-[3-[2-(2-methoxyethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]furan-2-yl]methanol
SYSTEMATIC NAME: [5-[[(2S)-2-[3-[2-(2-methoxyethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]furan-2-yl]methanol
MOLECULAR FORMULA: C20H25N5O4
MOLECULAR WEIGHT: 399.4436
SMILES: COCCNC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=C(O4)CO
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Product OPENEYE NAME: 3-[5-[(2S)-1-(1H-indol-3-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
CAS Name: 3-[5-[(2S)-1-(1H-indol-3-ylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)-2-pyridinamine
IUPAC NAME: 3-[5-[(2S)-1-(1H-indol-3-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
SYSTEMATIC NAME: 3-[5-[(2S)-1-(1H-indol-3-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
MOLECULAR FORMULA: C23H26N6O2
MOLECULAR WEIGHT: 418.49154
SMILES: COCCNC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CNC5=CC=CC=C54
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Product OPENEYE NAME: 3-[5-[(2S)-1-isobutylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
CAS Name: N-(2-methoxyethyl)-3-[5-[(2S)-1-(2-methylpropyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C18H27N5O2
MOLECULAR WEIGHT: 345.43928
SMILES: CC(C)CN1CCC[C@H]1C2=NC(=NO2)C3=C(N=CC=C3)NCCOC
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Product OPENEYE NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-[(2-methoxyphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N-(2-methoxyethyl)-3-[5-[(2S)-1-[(2-methoxyphenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-[(2-methoxyphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-[(2-methoxyphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C22H27N5O3
MOLECULAR WEIGHT: 409.48148
SMILES: COCCNC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CC=C4OC
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Product OPENEYE NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-(1-methyl-4-piperidyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N-(2-methoxyethyl)-3-[5-[(2S)-1-(1-methyl-4-piperidinyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C20H30N6O2
MOLECULAR WEIGHT: 386.4912
SMILES: CN1CCC(CC1)N2CCC[C@H]2C3=NC(=NO3)C4=C(N=CC=C4)NCCOC
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Product OPENEYE NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-[(4-nitrophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N-(2-methoxyethyl)-3-[5-[(2S)-1-[(4-nitrophenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-[(4-nitrophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N-(2-methoxyethyl)-3-[5-[(2S)-1-[(4-nitrophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C21H24N6O4
MOLECULAR WEIGHT: 424.45306
SMILES: COCCNC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=C(C=C4)[N+](=O)[O-]
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Product OPENEYE NAME: 3-[5-[(2S)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
CAS Name: 3-[5-[(2S)-1-(1,3-benzodioxol-5-ylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)-2-pyridinamine
IUPAC NAME: 3-[5-[(2S)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
SYSTEMATIC NAME: 3-[5-[(2S)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine
MOLECULAR FORMULA: C22H25N5O4
MOLECULAR WEIGHT: 423.465
SMILES: COCCNC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC5=C(C=C4)OCO5
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