2-[(4,6-dimethylquinazolin-2-yl)amino]-6-(2-methylphenyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(4,6-dimethylquinazolin-2-yl)amino]-6-(2-methylphenyl)-1H-pyrimidin-4-one Openeye Name: 2-[(4,6-dimethylquinazolin-2-yl)amino]-6-(o-tolyl)-1H-pyrimidin-4-one CAS Name: 2-[(4,6-dimethyl-2-quinazolinyl)amino]-6-(2-methylphenyl)-1H-pyrimidin-4-one IUPAC Name: 2-[(4,6-dimethylquinazolin-2-yl)amino]-6-(2-methylphenyl)-1H-pyrimidin-4-one Traditional Name: 2-[(4,6-dimethylquinazolin-2-yl)amino]-6-(o-tolyl)-1H-pyrimidin-4-one Formula: C21H19N5O MolecularWeight: 357.40846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=O)C=C(N3)C4=CC=CC=C4C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=O)C=C(N3)C4=CC=CC=C4C

InChI

InChI=1S/C21H19N5O/c1-12-8-9-17-16(10-12)14(3)22-20(23-17)26-21-24-18(11-19(27)25-21)15-7-5-4-6-13(15)2/h4-11H,1-3H3,(H2,22,23,24,25,26,27)