4-oxidanylidene-2-[(phenylmethyl)amino]pyrimido[2,1-a]isoquinoline-3-carbonitrile

Systemtic Name: 4-oxidanylidene-2-[(phenylmethyl)amino]pyrimido[2,1-a]isoquinoline-3-carbonitrile Openeye Name: 2-(benzylamino)-4-oxo-pyrimido[2,1-a]isoquinoline-3-carbonitrile CAS Name: 4-oxo-2-[(phenylmethyl)amino]-3-pyrimido[2,1-a]isoquinolinecarbonitrile IUPAC Name: 2-(benzylamino)-4-oxopyrimido[2,1-a]isoquinoline-3-carbonitrile Traditional Name: 2-(benzylamino)-4-keto-pyrimid[2,1-a]isoquinoline-3-carbonitrile Formula: C20H14N4O MolecularWeight: 326.35136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=O)N3C=CC4=CC=CC=C4C3=N2)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=O)N3C=CC4=CC=CC=C4C3=N2)C#N

InChI

InChI=1S/C20H14N4O/c21-12-17-18(22-13-14-6-2-1-3-7-14)23-19-16-9-5-4-8-15(16)10-11-24(19)20(17)25/h1-11,22H,13H2