Saturday, January 5, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N,N-dimethyl-5-[5-[(2S)-1-tetrahydropyran-4-ylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-(4-oxanyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-(oxan-4-yl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-(oxan-4-yl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C18H25N5O2
MOLECULAR WEIGHT: 343.4234
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3C4CCOCC4
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Product OPENEYE NAME: N,N-dimethyl-5-[5-[(2S)-1-(2-thienylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-(thiophen-2-ylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-(thiophen-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-(thiophen-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C18H21N5OS
MOLECULAR WEIGHT: 355.45724
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CS4
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Product OPENEYE NAME: N,N-dimethyl-5-[5-[(2S)-1-(p-tolylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-[(4-methylphenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-[(4-methylphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-[(4-methylphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C21H25N5O
MOLECULAR WEIGHT: 363.4561
SMILES: CC1=CC=C(C=C1)CN2CCC[C@H]2C3=NC(=NO3)C4=CN=C(C=C4)N(C)C
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Product OPENEYE NAME: N,N-dimethyl-5-[5-[(2S)-1-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-[[4-(trifluoromethyl)phenyl]methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C21H22F3N5O
MOLECULAR WEIGHT: 417.42749
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=C(C=C4)C(F)(F)F
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Product OPENEYE NAME: N,N-dimethyl-5-[5-[(2S)-1-[(3,4,5-trimethoxyphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-[(3,4,5-trimethoxyphenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-[(3,4,5-trimethoxyphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-[(3,4,5-trimethoxyphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C23H29N5O4
MOLECULAR WEIGHT: 439.50746
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC(=C(C(=C4)OC)OC)OC
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Product OPENEYE NAME: 5-[5-[(2S)-1-isopropylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-propan-2-yl-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-propan-2-ylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-propan-2-ylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C16H23N5O
MOLECULAR WEIGHT: 301.38672
SMILES: CC(C)N1CCC[C@H]1C2=NC(=NO2)C3=CN=C(C=C3)N(C)C
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Product OPENEYE NAME: N-[4-[[(2S)-2-[3-[6-(dimethylamino)-3-pyridyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]phenyl]acetamide
CAS Name: N-[4-[[(2S)-2-[3-[6-(dimethylamino)-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]methyl]phenyl]acetamide
IUPAC NAME: N-[4-[[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]phenyl]ethanamide
MOLECULAR FORMULA: C22H26N6O2
MOLECULAR WEIGHT: 406.48084
SMILES: CC(=O)NC1=CC=C(C=C1)CN2CCC[C@H]2C3=NC(=NO3)C4=CN=C(C=C4)N(C)C
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Product OPENEYE NAME: N,N-dimethyl-5-[5-[(2S)-1-[(1-methylindol-3-yl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-[(1-methyl-3-indolyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-[(1-methylindol-3-yl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-[(1-methylindol-3-yl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C23H26N6O
MOLECULAR WEIGHT: 402.49214
SMILES: CN1C=C(C2=CC=CC=C21)CN3CCC[C@H]3C4=NC(=NO4)C5=CN=C(C=C5)N(C)C
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Product OPENEYE NAME: 5-[5-[(2S)-1-(benzofuran-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
CAS Name: 5-[5-[(2S)-1-(2-benzofuranylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-2-pyridinamine
IUPAC NAME: 5-[5-[(2S)-1-(1-benzofuran-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylpyridin-2-amine
SYSTEMATIC NAME: 5-[5-[(2S)-1-(1-benzofuran-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
MOLECULAR FORMULA: C22H23N5O2
MOLECULAR WEIGHT: 389.45032
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC5=CC=CC=C5O4
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Product OPENEYE NAME: 5-[5-[(2S)-1-(1H-imidazol-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
CAS Name: 5-[5-[(2S)-1-(1H-imidazol-2-ylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-2-pyridinamine
IUPAC NAME: 5-[5-[(2S)-1-(1H-imidazol-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylpyridin-2-amine
SYSTEMATIC NAME: 5-[5-[(2S)-1-(1H-imidazol-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
MOLECULAR FORMULA: C17H21N7O
MOLECULAR WEIGHT: 339.39494
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=NC=CN4
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Product OPENEYE NAME: 5-[5-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
CAS Name: 5-[5-[(2S)-1-(cyclopropylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-2-pyridinamine
IUPAC NAME: 5-[5-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylpyridin-2-amine
SYSTEMATIC NAME: 5-[5-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
MOLECULAR FORMULA: C17H23N5O
MOLECULAR WEIGHT: 313.39742
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4CC4
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Product OPENEYE NAME: N,N-dimethyl-5-[5-[(2S)-1-[[3-(trifluoromethoxy)phenyl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-[[3-(trifluoromethoxy)phenyl]methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-[[3-(trifluoromethoxy)phenyl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-[[3-(trifluoromethyloxy)phenyl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C21H22F3N5O2
MOLECULAR WEIGHT: 433.42689
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC(=CC=C4)OC(F)(F)F
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Product OPENEYE NAME: 2-[[(2S)-2-[3-[6-(dimethylamino)-3-pyridyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]-5-methoxy-phenol
CAS Name: 2-[[(2S)-2-[3-[6-(dimethylamino)-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]methyl]-5-methoxyphenol
IUPAC NAME: 2-[[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]-5-methoxyphenol
SYSTEMATIC NAME: 2-[[(2S)-2-[3-[6-(dimethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]-5-methoxy-phenol
MOLECULAR FORMULA: C21H25N5O3
MOLECULAR WEIGHT: 395.4549
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=C(C=C(C=C4)OC)O
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Product OPENEYE NAME: 5-[5-[(2S)-1-cyclobutylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
CAS Name: 5-[5-[(2S)-1-cyclobutyl-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-2-pyridinamine
IUPAC NAME: 5-[5-[(2S)-1-cyclobutylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylpyridin-2-amine
SYSTEMATIC NAME: 5-[5-[(2S)-1-cyclobutylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-pyridin-2-amine
MOLECULAR FORMULA: C17H23N5O
MOLECULAR WEIGHT: 313.39742
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3C4CCC4
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Product OPENEYE NAME: N,N-dimethyl-5-[5-[(2S)-1-[(5-methyl-2-furyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-[(5-methyl-2-furanyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C19H23N5O2
MOLECULAR WEIGHT: 353.41822
SMILES: CC1=CC=C(O1)CN2CCC[C@H]2C3=NC(=NO3)C4=CN=C(C=C4)N(C)C
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Product OPENEYE NAME: N,N-dimethyl-5-[5-[(2S)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-[(4-methylsulfonylphenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C21H25N5O3S
MOLECULAR WEIGHT: 427.5199
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=C(C=C4)S(=O)(=O)C
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Product OPENEYE NAME: N,N-dimethyl-5-[5-[(2S)-1-pyrimidin-2-ylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
CAS Name: N,N-dimethyl-5-[5-[(2S)-1-(2-pyrimidinyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinamine
IUPAC NAME: N,N-dimethyl-5-[5-[(2S)-1-pyrimidin-2-ylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
SYSTEMATIC NAME: N,N-dimethyl-5-[5-[(2S)-1-pyrimidin-2-ylpyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
MOLECULAR FORMULA: C17H19N7O
MOLECULAR WEIGHT: 337.37906
SMILES: CN(C)C1=NC=C(C=C1)C2=NOC(=N2)[C@@H]3CCCN3C4=NC=CC=N4
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Product OPENEYE NAME: 1-[4-[(2S)-2-[3-(2-pyrrolidin-1-yl-4-pyridyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-1-piperidyl]ethanone
CAS Name: 1-[4-[(2S)-2-[3-[2-(1-pyrrolidinyl)-4-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]-1-piperidinyl]ethanone
IUPAC NAME: 1-[4-[(2S)-2-[3-(2-pyrrolidin-1-ylpyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]piperidin-1-yl]ethanone
SYSTEMATIC NAME: 1-[4-[(2S)-2-[3-(2-pyrrolidin-1-ylpyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]piperidin-1-yl]ethanone
MOLECULAR FORMULA: C22H30N6O2
MOLECULAR WEIGHT: 410.5126
SMILES: CC(=O)N1CCC(CC1)N2CCC[C@H]2C3=NC(=NO3)C4=CC(=NC=C4)N5CCCC5
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Product OPENEYE NAME: 5-[(2S)-1-benzylpyrrolidin-2-yl]-3-(2-pyrrolidin-1-yl-4-pyridyl)-1,2,4-oxadiazole
CAS Name: 5-[(2S)-1-(phenylmethyl)-2-pyrrolidinyl]-3-[2-(1-pyrrolidinyl)-4-pyridinyl]-1,2,4-oxadiazole
IUPAC NAME: 5-[(2S)-1-benzylpyrrolidin-2-yl]-3-(2-pyrrolidin-1-ylpyridin-4-yl)-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[(2S)-1-(phenylmethyl)pyrrolidin-2-yl]-3-(2-pyrrolidin-1-ylpyridin-4-yl)-1,2,4-oxadiazole
MOLECULAR FORMULA: C22H25N5O
MOLECULAR WEIGHT: 375.4668
SMILES: C1CCN(C1)C2=NC=CC(=C2)C3=NOC(=N3)[C@@H]4CCCN4CC5=CC=CC=C5
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Product OPENEYE NAME: 5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-3-(2-pyrrolidin-1-yl-4-pyridyl)-1,2,4-oxadiazole
CAS Name: 5-[(2S)-1-[(2-fluorophenyl)methyl]-2-pyrrolidinyl]-3-[2-(1-pyrrolidinyl)-4-pyridinyl]-1,2,4-oxadiazole
IUPAC NAME: 5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-3-(2-pyrrolidin-1-ylpyridin-4-yl)-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-3-(2-pyrrolidin-1-ylpyridin-4-yl)-1,2,4-oxadiazole
MOLECULAR FORMULA: C22H24FN5O
MOLECULAR WEIGHT: 393.457263
SMILES: C1CCN(C1)C2=NC=CC(=C2)C3=NOC(=N3)[C@@H]4CCCN4CC5=CC=CC=C5F
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