8-[2-[4-(diphenylmethyl)piperazin-1-yl]ethyl]-3-(2-methylpropyl)-7H-purine-2,6-dione

Systemtic Name: 8-[2-[4-(diphenylmethyl)piperazin-1-yl]ethyl]-3-(2-methylpropyl)-7H-purine-2,6-dione Openeye Name: 8-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-3-isobutyl-7H-purine-2,6-dione CAS Name: 8-[2-[4-(diphenylmethyl)-1-piperazinyl]ethyl]-3-(2-methylpropyl)-7H-purine-2,6-dione IUPAC Name: 8-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-3-(2-methylpropyl)-7H-purine-2,6-dione Traditional Name: 8-[2-(4-benzhydrylpiperazino)ethyl]-3-isobutyl-7H-purine-2,6-quinone Formula: C28H34N6O2 MolecularWeight: 486.60856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=O)NC1=O)NC(=N2)CCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)CN1C2=C(C(=O)NC1=O)NC(=N2)CCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H34N6O2/c1-20(2)19-34-26-24(27(35)31-28(34)36)29-23(30-26)13-14-32-15-17-33(18-16-32)25(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-12,20,25H,13-19H2,1-2H3,(H,29,30)(H,31,35,36)