1-(3-methylphenyl)-6-(1-phenylethyl)-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 1-(3-methylphenyl)-6-(1-phenylethyl)-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 1-(m-tolyl)-6-(1-phenylethyl)-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 1-(3-methylphenyl)-6-(1-phenylethyl)-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 1-(3-methylphenyl)-6-(1-phenylethyl)-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 1-(m-tolyl)-6-(1-phenylethyl)-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=C(CN(CN3)C(C)C4=CC=CC=C4)C(=O)NC2=O

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=C(CN(CN3)C(C)C4=CC=CC=C4)C(=O)NC2=O

InChI

InChI=1S/C21H22N4O2/c1-14-7-6-10-17(11-14)25-19-18(20(26)23-21(25)27)12-24(13-22-19)15(2)16-8-4-3-5-9-16/h3-11,15,22H,12-13H2,1-2H3,(H,23,26,27)