(2S)-N-[(1S)-1-cyano-2-[4-(2-methylpyridin-3-yl)phenyl]ethyl]piperidine-2-carboxamide

Systemtic Name: (2S)-N-[(1S)-1-cyano-2-[4-(2-methylpyridin-3-yl)phenyl]ethyl]piperidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-1-cyano-2-[4-(2-methyl-3-pyridyl)phenyl]ethyl]piperidine-2-carboxamide CAS Name: (2S)-N-[(1S)-1-cyano-2-[4-(2-methyl-3-pyridinyl)phenyl]ethyl]-2-piperidinecarboxamide IUPAC Name: (2S)-N-[(1S)-1-cyano-2-[4-(2-methylpyridin-3-yl)phenyl]ethyl]piperidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-1-cyano-2-[4-(2-methyl-3-pyridyl)phenyl]ethyl]pipecolinamide Formula: C21H24N4O MolecularWeight: 348.44146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)C2=CC=C(C=C2)CC(C#N)NC(=O)C3CCCCN3

Isomeric SMILES

CC1=C(C=CC=N1)C2=CC=C(C=C2)C[C@@H](C#N)NC(=O)[C@@H]3CCCCN3

InChI

InChI=1S/C21H24N4O/c1-15-19(5-4-12-23-15)17-9-7-16(8-10-17)13-18(14-22)25-21(26)20-6-2-3-11-24-20/h4-5,7-10,12,18,20,24H,2-3,6,11,13H2,1H3,(H,25,26)/t18-,20-/m0/s1