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

Systemtic Name: 2-[1-[3-(cyanomethyl)phenyl]-2-oxidanylidene-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile Openeye Name: 2-[1-[3-(cyanomethyl)phenyl]-2-oxo-5-(2-pyridyl)-3-pyridyl]benzonitrile CAS Name: 2-[1-[3-(cyanomethyl)phenyl]-2-oxo-5-(2-pyridinyl)-3-pyridinyl]benzonitrile IUPAC Name: 2-[1-[3-(cyanomethyl)phenyl]-2-oxo-5-pyridin-2-ylpyridin-3-yl]benzonitrile Traditional Name: 2-[1-[3-(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)C#N)C2=CC(=CN(C2=O)C3=CC=CC(=C3)CC#N)C4=CC=CC=N4

Isomeric SMILES

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

InChI

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