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

Systemtic Name: 8-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1,3-dimethyl-7-(phenylmethyl)purine-2,6-dione Openeye Name: 8-[(4-benzhydrylpiperazin-1-yl)methyl]-7-benzyl-1,3-dimethyl-purine-2,6-dione CAS Name: 8-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-1,3-dimethyl-7-(phenylmethyl)purine-2,6-dione IUPAC Name: 8-[(4-benzhydrylpiperazin-1-yl)methyl]-7-benzyl-1,3-dimethylpurine-2,6-dione Traditional Name: 8-[(4-benzhydrylpiperazino)methyl]-7-benzyl-1,3-dimethyl-xanthine Formula: C32H34N6O2 MolecularWeight: 534.65136

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)CC6=CC=CC=C6

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)CC6=CC=CC=C6

InChI

InChI=1S/C32H34N6O2/c1-34-30-29(31(39)35(2)32(34)40)38(22-24-12-6-3-7-13-24)27(33-30)23-36-18-20-37(21-19-36)28(25-14-8-4-9-15-25)26-16-10-5-11-17-26/h3-17,28H,18-23H2,1-2H3