1-methyl-3-[2-(4-methylphenyl)ethyl]-8-[(4-methylphenyl)methyl]-7H-purine-2,6-dione

Systemtic Name: 1-methyl-3-[2-(4-methylphenyl)ethyl]-8-[(4-methylphenyl)methyl]-7H-purine-2,6-dione Openeye Name: 1-methyl-3-[2-(p-tolyl)ethyl]-8-(p-tolylmethyl)-7H-purine-2,6-dione CAS Name: 1-methyl-3-[2-(4-methylphenyl)ethyl]-8-[(4-methylphenyl)methyl]-7H-purine-2,6-dione IUPAC Name: 1-methyl-3-[2-(4-methylphenyl)ethyl]-8-[(4-methylphenyl)methyl]-7H-purine-2,6-dione Traditional Name: 1-methyl-8-(4-methylbenzyl)-3-[2-(p-tolyl)ethyl]-7H-purine-2,6-quinone Formula: C23H24N4O2 MolecularWeight: 388.46226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCN2C3=C(C(=O)N(C2=O)C)NC(=N3)CC4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)CCN2C3=C(C(=O)N(C2=O)C)NC(=N3)CC4=CC=C(C=C4)C

InChI

InChI=1S/C23H24N4O2/c1-15-4-8-17(9-5-15)12-13-27-21-20(22(28)26(3)23(27)29)24-19(25-21)14-18-10-6-16(2)7-11-18/h4-11H,12-14H2,1-3H3,(H,24,25)