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

Systemtic Name: 1,3-dimethyl-8-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-[4-(p-tolylmethyl)piperazin-1-yl]-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-[4-[(4-methylphenyl)methyl]-1-piperazinyl]-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-[4-(4-methylbenzyl)piperazino]-7H-purine-2,6-quinone Formula: C19H24N6O2 MolecularWeight: 368.43286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC4=C(N3)C(=O)N(C(=O)N4C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC4=C(N3)C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C19H24N6O2/c1-13-4-6-14(7-5-13)12-24-8-10-25(11-9-24)18-20-15-16(21-18)22(2)19(27)23(3)17(15)26/h4-7H,8-12H2,1-3H3,(H,20,21)