2-[1-[2-(cyanomethyl)phenyl]-2-oxidanylidene-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile

Systemtic Name: 2-[1-[2-(cyanomethyl)phenyl]-2-oxidanylidene-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile Openeye Name: 2-[1-[2-(cyanomethyl)phenyl]-2-oxo-5-(2-pyridyl)-3-pyridyl]benzonitrile CAS Name: 2-[1-[2-(cyanomethyl)phenyl]-2-oxo-5-(2-pyridinyl)-3-pyridinyl]benzonitrile IUPAC Name: 2-[1-[2-(cyanomethyl)phenyl]-2-oxo-5-pyridin-2-ylpyridin-3-yl]benzonitrile Traditional Name: 2-[1-[2-(cyanomethyl)phenyl]-2-keto-5-(2-pyridyl)-3-pyridyl]benzonitrile Formula: C25H16N4O MolecularWeight: 388.42074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC#N)N2C=C(C=C(C2=O)C3=CC=CC=C3C#N)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C(=C1)CC#N)N2C=C(C=C(C2=O)C3=CC=CC=C3C#N)C4=CC=CC=N4

InChI

InChI=1S/C25H16N4O/c26-13-12-18-7-2-4-11-24(18)29-17-20(23-10-5-6-14-28-23)15-22(25(29)30)21-9-3-1-8-19(21)16-27/h1-11,14-15,17H,12H2