6-(4-methylphenyl)-4-oxidanylidene-2-[(phenylmethyl)amino]-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-methylphenyl)-4-oxidanylidene-2-[(phenylmethyl)amino]-1H-pyrimidine-5-carbonitrile Openeye Name: 2-(benzylamino)-4-oxo-6-(p-tolyl)-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-methylphenyl)-4-oxo-2-[(phenylmethyl)amino]-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-(benzylamino)-6-(4-methylphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2-(benzylamino)-4-keto-6-(p-tolyl)-1H-pyrimidine-5-carbonitrile Formula: C19H16N4O MolecularWeight: 316.35654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NCC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NCC3=CC=CC=C3)C#N

InChI

InChI=1S/C19H16N4O/c1-13-7-9-15(10-8-13)17-16(11-20)18(24)23-19(22-17)21-12-14-5-3-2-4-6-14/h2-10H,12H2,1H3,(H2,21,22,23,24)