2-[[(4-oxidanylidenepyrido[1,2-a]pyrimidin-3-yl)amino]methyl]benzenecarbonitrile

Systemtic Name: 2-[[(4-oxidanylidenepyrido[1,2-a]pyrimidin-3-yl)amino]methyl]benzenecarbonitrile Openeye Name: 2-[[(4-oxopyrido[1,2-a]pyrimidin-3-yl)amino]methyl]benzonitrile CAS Name: 2-[[(4-oxo-3-pyrido[1,2-a]pyrimidinyl)amino]methyl]benzonitrile IUPAC Name: 2-[[(4-oxopyrido[1,2-a]pyrimidin-3-yl)amino]methyl]benzonitrile Traditional Name: 2-[[(4-ketopyrido[1,2-a]pyrimidin-3-yl)amino]methyl]benzonitrile Formula: C16H12N4O MolecularWeight: 276.29268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=CN=C3C=CC=CN3C2=O)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=CN=C3C=CC=CN3C2=O)C#N

InChI

InChI=1S/C16H12N4O/c17-9-12-5-1-2-6-13(12)10-18-14-11-19-15-7-3-4-8-20(15)16(14)21/h1-8,11,18H,10H2