(2S)-N-(cyanomethyl)-4-methyl-2-[[4-(3-methylpyridin-2-yl)phenyl]-phenyl-methoxy]pentanamide

Systemtic Name: (2S)-N-(cyanomethyl)-4-methyl-2-[[4-(3-methylpyridin-2-yl)phenyl]-phenyl-methoxy]pentanamide Openeye Name: (2S)-N-(cyanomethyl)-4-methyl-2-[[4-(3-methyl-2-pyridyl)phenyl]-phenyl-methoxy]pentanamide CAS Name: (2S)-N-(cyanomethyl)-4-methyl-2-[[4-(3-methyl-2-pyridinyl)phenyl]-phenylmethoxy]pentanamide IUPAC Name: (2S)-N-(cyanomethyl)-4-methyl-2-[[4-(3-methylpyridin-2-yl)phenyl]-phenylmethoxy]pentanamide Traditional Name: (2S)-N-(cyanomethyl)-4-methyl-2-[[4-(3-methyl-2-pyridyl)phenyl]-phenyl-methoxy]valeramide Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C2=CC=C(C=C2)C(C3=CC=CC=C3)OC(CC(C)C)C(=O)NCC#N

Isomeric SMILES

CC1=C(N=CC=C1)C2=CC=C(C=C2)C(C3=CC=CC=C3)O[C@@H](CC(C)C)C(=O)NCC#N

InChI

InChI=1S/C27H29N3O2/c1-19(2)18-24(27(31)30-17-15-28)32-26(22-9-5-4-6-10-22)23-13-11-21(12-14-23)25-20(3)8-7-16-29-25/h4-14,16,19,24,26H,17-18H2,1-3H3,(H,30,31)/t24-,26?/m0/s1