1-methyl-4-(4-methylphenyl)-6-(phenylmethyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione

Systemtic Name: 1-methyl-4-(4-methylphenyl)-6-(phenylmethyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Openeye Name: 6-benzyl-1-methyl-4-(p-tolyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione CAS Name: 1-methyl-4-(4-methylphenyl)-6-(phenylmethyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione IUPAC Name: 6-benzyl-1-methyl-4-(4-methylphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Traditional Name: 6-benzyl-1-methyl-4-(p-tolyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-quinone Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3=C(CN(C3=O)CC4=CC=CC=C4)N(C(=O)N2)C

Isomeric SMILES

CC1=CC=C(C=C1)C2C3=C(CN(C3=O)CC4=CC=CC=C4)N(C(=O)N2)C

InChI

InChI=1S/C21H21N3O2/c1-14-8-10-16(11-9-14)19-18-17(23(2)21(26)22-19)13-24(20(18)25)12-15-6-4-3-5-7-15/h3-11,19H,12-13H2,1-2H3,(H,22,26)