2-(2-oxidanylidene-1-piperidin-3-yl-5-pyridin-2-yl-pyridin-3-yl)benzenecarbonitrile

Systemtic Name: 2-(2-oxidanylidene-1-piperidin-3-yl-5-pyridin-2-yl-pyridin-3-yl)benzenecarbonitrile Openeye Name: 2-[2-oxo-1-(3-piperidyl)-5-(2-pyridyl)-3-pyridyl]benzonitrile CAS Name: 2-[2-oxo-1-(3-piperidinyl)-5-(2-pyridinyl)-3-pyridinyl]benzonitrile IUPAC Name: 2-(2-oxo-1-piperidin-3-yl-5-pyridin-2-ylpyridin-3-yl)benzonitrile Traditional Name: 2-[2-keto-1-(3-piperidyl)-5-(2-pyridyl)-3-pyridyl]benzonitrile Formula: C22H20N4O MolecularWeight: 356.4204

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)N2C=C(C=C(C2=O)C3=CC=CC=C3C#N)C4=CC=CC=N4

Isomeric SMILES

C1CC(CNC1)N2C=C(C=C(C2=O)C3=CC=CC=C3C#N)C4=CC=CC=N4

InChI

InChI=1S/C22H20N4O/c23-13-16-6-1-2-8-19(16)20-12-17(21-9-3-4-11-25-21)15-26(22(20)27)18-7-5-10-24-14-18/h1-4,6,8-9,11-12,15,18,24H,5,7,10,14H2