(2S)-N-[[2-(2,6-dimethylphenoxy)pyridin-3-yl]methyl]-2-imidazol-1-yl-propanamide

Systemtic Name: (2S)-N-[[2-(2,6-dimethylphenoxy)pyridin-3-yl]methyl]-2-imidazol-1-yl-propanamide Openeye Name: (2S)-N-[[2-(2,6-dimethylphenoxy)-3-pyridyl]methyl]-2-imidazol-1-yl-propanamide CAS Name: (2S)-N-[[2-(2,6-dimethylphenoxy)-3-pyridinyl]methyl]-2-(1-imidazolyl)propanamide IUPAC Name: (2S)-N-[[2-(2,6-dimethylphenoxy)pyridin-3-yl]methyl]-2-imidazol-1-ylpropanamide Traditional Name: (2S)-N-[[2-(2,6-dimethylphenoxy)-3-pyridyl]methyl]-2-imidazol-1-yl-propionamide Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC2=C(C=CC=N2)CNC(=O)C(C)N3C=CN=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC2=C(C=CC=N2)CNC(=O)[C@H](C)N3C=CN=C3

InChI

InChI=1S/C20H22N4O2/c1-14-6-4-7-15(2)18(14)26-20-17(8-5-9-22-20)12-23-19(25)16(3)24-11-10-21-13-24/h4-11,13,16H,12H2,1-3H3,(H,23,25)/t16-/m0/s1