2-[4-oxidanylidene-2-[(phenylmethyl)amino]quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 2-[4-oxidanylidene-2-[(phenylmethyl)amino]quinazolin-3-yl]benzenecarbonitrile Openeye Name: 2-[2-(benzylamino)-4-oxo-quinazolin-3-yl]benzonitrile CAS Name: 2-[4-oxo-2-[(phenylmethyl)amino]-3-quinazolinyl]benzonitrile IUPAC Name: 2-[2-(benzylamino)-4-oxoquinazolin-3-yl]benzonitrile Traditional Name: 2-[2-(benzylamino)-4-keto-quinazolin-3-yl]benzonitrile Formula: C22H16N4O MolecularWeight: 352.38864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C#N

InChI

InChI=1S/C22H16N4O/c23-14-17-10-4-7-13-20(17)26-21(27)18-11-5-6-12-19(18)25-22(26)24-15-16-8-2-1-3-9-16/h1-13H,15H2,(H,24,25)