(2S)-N-[(1S)-1-cyano-2-(4-pyridin-3-ylphenyl)ethyl]piperidine-2-carboxamide

Systemtic Name: (2S)-N-[(1S)-1-cyano-2-(4-pyridin-3-ylphenyl)ethyl]piperidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-1-cyano-2-[4-(3-pyridyl)phenyl]ethyl]piperidine-2-carboxamide CAS Name: (2S)-N-[(1S)-1-cyano-2-[4-(3-pyridinyl)phenyl]ethyl]-2-piperidinecarboxamide IUPAC Name: (2S)-N-[(1S)-1-cyano-2-(4-pyridin-3-ylphenyl)ethyl]piperidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-1-cyano-2-[4-(3-pyridyl)phenyl]ethyl]pipecolinamide Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)C(=O)NC(CC2=CC=C(C=C2)C3=CN=CC=C3)C#N

Isomeric SMILES

C1CCN[C@@H](C1)C(=O)N[C@@H](CC2=CC=C(C=C2)C3=CN=CC=C3)C#N

InChI

InChI=1S/C20H22N4O/c21-13-18(24-20(25)19-5-1-2-11-23-19)12-15-6-8-16(9-7-15)17-4-3-10-22-14-17/h3-4,6-10,14,18-19,23H,1-2,5,11-12H2,(H,24,25)/t18-,19-/m0/s1