2-azanyl-4-[(1S)-1-cyano-2-phenyl-ethyl]-6-piperidin-1-yl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-[(1S)-1-cyano-2-phenyl-ethyl]-6-piperidin-1-yl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-[(1S)-1-cyano-2-phenyl-ethyl]-6-(1-piperidyl)pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-[(1S)-1-cyano-2-phenylethyl]-6-(1-piperidinyl)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-[(1S)-1-cyano-2-phenylethyl]-6-piperidin-1-ylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-[(1S)-1-cyano-2-phenyl-ethyl]-6-piperidino-dinicotinonitrile Formula: C21H20N6 MolecularWeight: 356.4237

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=C(C(=C2C#N)C(CC3=CC=CC=C3)C#N)C#N)N

Isomeric SMILES

C1CCN(CC1)C2=NC(=C(C(=C2C#N)[C@H](CC3=CC=CC=C3)C#N)C#N)N

InChI

InChI=1S/C21H20N6/c22-12-16(11-15-7-3-1-4-8-15)19-17(13-23)20(25)26-21(18(19)14-24)27-9-5-2-6-10-27/h1,3-4,7-8,16H,2,5-6,9-11H2,(H2,25,26)/t16-/m1/s1