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

Systemtic Name: (2S)-N-[(1S)-1-cyano-2-[4-(1-methylpyrazol-4-yl)phenyl]ethyl]piperidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-1-cyano-2-[4-(1-methylpyrazol-4-yl)phenyl]ethyl]piperidine-2-carboxamide CAS Name: (2S)-N-[(1S)-1-cyano-2-[4-(1-methyl-4-pyrazolyl)phenyl]ethyl]-2-piperidinecarboxamide IUPAC Name: (2S)-N-[(1S)-1-cyano-2-[4-(1-methylpyrazol-4-yl)phenyl]ethyl]piperidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-1-cyano-2-[4-(1-methylpyrazol-4-yl)phenyl]ethyl]pipecolinamide Formula: C19H23N5O MolecularWeight: 337.41882

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=CC=C(C=C2)CC(C#N)NC(=O)C3CCCCN3

Isomeric SMILES

CN1C=C(C=N1)C2=CC=C(C=C2)C[C@@H](C#N)NC(=O)[C@@H]3CCCCN3

InChI

InChI=1S/C19H23N5O/c1-24-13-16(12-22-24)15-7-5-14(6-8-15)10-17(11-20)23-19(25)18-4-2-3-9-21-18/h5-8,12-13,17-18,21H,2-4,9-10H2,1H3,(H,23,25)/t17-,18-/m0/s1