Friday, January 4, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 5-[(2S)-1-[(4-chlorophenyl)methyl]pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazole
CAS Name: 5-[(2S)-1-[(4-chlorophenyl)methyl]-2-pyrrolidinyl]-3-[2-(2-methoxyethoxy)-3-pyridinyl]-1,2,4-oxadiazole
IUPAC NAME: 5-[(2S)-1-[(4-chlorophenyl)methyl]pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[(2S)-1-[(4-chlorophenyl)methyl]pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C21H23ClN4O3
MOLECULAR WEIGHT: 414.88532
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=C(C=C4)Cl
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Product OPENEYE NAME: 3-[[(2S)-2-[3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzonitrile
CAS Name: 3-[[(2S)-2-[3-[2-(2-methoxyethoxy)-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]methyl]benzonitrile
IUPAC NAME: 3-[[(2S)-2-[3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 3-[[(2S)-2-[3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C22H23N5O3
MOLECULAR WEIGHT: 405.44972
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CC(=C4)C#N
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Product OPENEYE NAME: 5-[(2S)-1-(cyclohexylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazole
CAS Name: 5-[(2S)-1-(cyclohexylmethyl)-2-pyrrolidinyl]-3-[2-(2-methoxyethoxy)-3-pyridinyl]-1,2,4-oxadiazole
IUPAC NAME: 5-[(2S)-1-(cyclohexylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[(2S)-1-(cyclohexylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C21H30N4O3
MOLECULAR WEIGHT: 386.4879
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4CCCCC4
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Product OPENEYE NAME: 5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazole
CAS Name: 5-[(2S)-1-[(2-fluorophenyl)methyl]-2-pyrrolidinyl]-3-[2-(2-methoxyethoxy)-3-pyridinyl]-1,2,4-oxadiazole
IUPAC NAME: 5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[(2S)-1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C21H23FN4O3
MOLECULAR WEIGHT: 398.430723
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CC=C4F
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Product OPENEYE NAME: 3-[2-(2-methoxyethoxy)-3-pyridyl]-5-[(2S)-1-methylpyrrolidin-2-yl]-1,2,4-oxadiazole
CAS Name: 3-[2-(2-methoxyethoxy)-3-pyridinyl]-5-[(2S)-1-methyl-2-pyrrolidinyl]-1,2,4-oxadiazole
IUPAC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-methylpyrrolidin-2-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-methylpyrrolidin-2-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C15H20N4O3
MOLECULAR WEIGHT: 304.3443
SMILES: CN1CCC[C@H]1C2=NC(=NO2)C3=C(N=CC=C3)OCCOC
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Product OPENEYE NAME: 5-[(2S)-1-(2-furylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazole
CAS Name: 5-[(2S)-1-(2-furanylmethyl)-2-pyrrolidinyl]-3-[2-(2-methoxyethoxy)-3-pyridinyl]-1,2,4-oxadiazole
IUPAC NAME: 5-[(2S)-1-(furan-2-ylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[(2S)-1-(furan-2-ylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C19H22N4O4
MOLECULAR WEIGHT: 370.40238
SMILES: COCCOC1=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-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]-2-furyl]methanol
CAS Name: [5-[[(2S)-2-[3-[2-(2-methoxyethoxy)-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]methyl]-2-furanyl]methanol
IUPAC NAME: [5-[[(2S)-2-[3-[2-(2-methoxyethoxy)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-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]furan-2-yl]methanol
MOLECULAR FORMULA: C20H24N4O5
MOLECULAR WEIGHT: 400.42836
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=C(O4)CO
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Product OPENEYE NAME: 5-[(2S)-1-(1H-indol-3-ylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazole
CAS Name: 5-[(2S)-1-(1H-indol-3-ylmethyl)-2-pyrrolidinyl]-3-[2-(2-methoxyethoxy)-3-pyridinyl]-1,2,4-oxadiazole
IUPAC NAME: 5-[(2S)-1-(1H-indol-3-ylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[(2S)-1-(1H-indol-3-ylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C23H25N5O3
MOLECULAR WEIGHT: 419.4763
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CNC5=CC=CC=C54
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Product OPENEYE NAME: 5-[(2S)-1-isobutylpyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazole
CAS Name: 3-[2-(2-methoxyethoxy)-3-pyridinyl]-5-[(2S)-1-(2-methylpropyl)-2-pyrrolidinyl]-1,2,4-oxadiazole
IUPAC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C18H26N4O3
MOLECULAR WEIGHT: 346.42404
SMILES: CC(C)CN1CCC[C@H]1C2=NC(=NO2)C3=C(N=CC=C3)OCCOC
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Product OPENEYE NAME: 3-[2-(2-methoxyethoxy)-3-pyridyl]-5-[(2S)-1-(1-methyl-4-piperidyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
CAS Name: 3-[2-(2-methoxyethoxy)-3-pyridinyl]-5-[(2S)-1-(1-methyl-4-piperidinyl)-2-pyrrolidinyl]-1,2,4-oxadiazole
IUPAC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C20H29N5O3
MOLECULAR WEIGHT: 387.47596
SMILES: CN1CCC(CC1)N2CCC[C@H]2C3=NC(=NO3)C4=C(N=CC=C4)OCCOC
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Product OPENEYE NAME: 3-[2-(2-methoxyethoxy)-3-pyridyl]-5-[(2S)-1-[(4-nitrophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole
CAS Name: 3-[2-(2-methoxyethoxy)-3-pyridinyl]-5-[(2S)-1-[(4-nitrophenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazole
IUPAC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-[(4-nitrophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-[(4-nitrophenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C21H23N5O5
MOLECULAR WEIGHT: 425.43782
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=C(C=C4)[N+](=O)[O-]
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Product OPENEYE NAME: 5-[(2S)-1-(2,2-dimethylpropyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazole
CAS Name: 5-[(2S)-1-(2,2-dimethylpropyl)-2-pyrrolidinyl]-3-[2-(2-methoxyethoxy)-3-pyridinyl]-1,2,4-oxadiazole
IUPAC NAME: 5-[(2S)-1-(2,2-dimethylpropyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[(2S)-1-(2,2-dimethylpropyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C19H28N4O3
MOLECULAR WEIGHT: 360.45062
SMILES: CC(C)(C)CN1CCC[C@H]1C2=NC(=NO2)C3=C(N=CC=C3)OCCOC
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Product OPENEYE NAME: 3-[2-(2-methoxyethoxy)-3-pyridyl]-5-[(2S)-1-(2-pyridylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
CAS Name: 3-[2-(2-methoxyethoxy)-3-pyridinyl]-5-[(2S)-1-(2-pyridinylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazole
IUPAC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C20H23N5O3
MOLECULAR WEIGHT: 381.42832
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CC=N4
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Product OPENEYE NAME: 3-[2-(2-methoxyethoxy)-3-pyridyl]-5-[(2S)-1-(3-pyridylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
CAS Name: 3-[2-(2-methoxyethoxy)-3-pyridinyl]-5-[(2S)-1-(3-pyridinylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazole
IUPAC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C20H23N5O3
MOLECULAR WEIGHT: 381.42832
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CN=CC=C4
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Product OPENEYE NAME: 3-[2-(2-methoxyethoxy)-3-pyridyl]-5-[(2S)-1-(4-pyridylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
CAS Name: 3-[2-(2-methoxyethoxy)-3-pyridinyl]-5-[(2S)-1-(pyridin-4-ylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazole
IUPAC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C20H23N5O3
MOLECULAR WEIGHT: 381.42832
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=NC=C4
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Product OPENEYE NAME: 3-[2-(2-methoxyethoxy)-3-pyridyl]-5-[(2S)-1-tetrahydropyran-4-ylpyrrolidin-2-yl]-1,2,4-oxadiazole
CAS Name: 3-[2-(2-methoxyethoxy)-3-pyridinyl]-5-[(2S)-1-(4-oxanyl)-2-pyrrolidinyl]-1,2,4-oxadiazole
IUPAC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(oxan-4-yl)pyrrolidin-2-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(oxan-4-yl)pyrrolidin-2-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C19H26N4O4
MOLECULAR WEIGHT: 374.43414
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3C4CCOCC4
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Product OPENEYE NAME: 3-[2-(2-methoxyethoxy)-3-pyridyl]-5-[(2S)-1-(2-thienylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
CAS Name: 3-[2-(2-methoxyethoxy)-3-pyridinyl]-5-[(2S)-1-(thiophen-2-ylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazole
IUPAC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(thiophen-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-(thiophen-2-ylmethyl)pyrrolidin-2-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C19H22N4O3S
MOLECULAR WEIGHT: 386.46798
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=CC=CS4
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Product OPENEYE NAME: 5-[(2S)-1-isopropylpyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazole
CAS Name: 3-[2-(2-methoxyethoxy)-3-pyridinyl]-5-[(2S)-1-propan-2-yl-2-pyrrolidinyl]-1,2,4-oxadiazole
IUPAC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-propan-2-ylpyrrolidin-2-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[2-(2-methoxyethoxy)pyridin-3-yl]-5-[(2S)-1-propan-2-ylpyrrolidin-2-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C17H24N4O3
MOLECULAR WEIGHT: 332.39746
SMILES: CC(C)N1CCC[C@H]1C2=NC(=NO2)C3=C(N=CC=C3)OCCOC
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Product OPENEYE NAME: N-[4-[[(2S)-2-[3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]phenyl]acetamide
CAS Name: N-[4-[[(2S)-2-[3-[2-(2-methoxyethoxy)-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]methyl]phenyl]acetamide
IUPAC NAME: N-[4-[[(2S)-2-[3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[[(2S)-2-[3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]phenyl]ethanamide
MOLECULAR FORMULA: C23H27N5O4
MOLECULAR WEIGHT: 437.49158
SMILES: CC(=O)NC1=CC=C(C=C1)CN2CCC[C@H]2C3=NC(=NO3)C4=C(N=CC=C4)OCCOC
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Product OPENEYE NAME: 5-[(2S)-1-(1H-imidazol-2-ylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazole
CAS Name: 5-[(2S)-1-(1H-imidazol-2-ylmethyl)-2-pyrrolidinyl]-3-[2-(2-methoxyethoxy)-3-pyridinyl]-1,2,4-oxadiazole
IUPAC NAME: 5-[(2S)-1-(1H-imidazol-2-ylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[(2S)-1-(1H-imidazol-2-ylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C18H22N6O3
MOLECULAR WEIGHT: 370.40568
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4=NC=CN4
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Product OPENEYE NAME: 5-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)-3-pyridyl]-1,2,4-oxadiazole
CAS Name: 5-[(2S)-1-(cyclopropylmethyl)-2-pyrrolidinyl]-3-[2-(2-methoxyethoxy)-3-pyridinyl]-1,2,4-oxadiazole
IUPAC NAME: 5-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-3-[2-(2-methoxyethoxy)pyridin-3-yl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C18H24N4O3
MOLECULAR WEIGHT: 344.40816
SMILES: COCCOC1=C(C=CC=N1)C2=NOC(=N2)[C@@H]3CCCN3CC4CC4
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