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

Systemtic Name: 8-[2-[4-(diphenylmethyl)piperazin-1-yl]ethyl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[2-[4-(diphenylmethyl)-1-piperazinyl]ethyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[2-(4-benzhydrylpiperazino)ethyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C26H30N6O2 MolecularWeight: 458.5554

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H30N6O2/c1-29-24-22(25(33)30(2)26(29)34)27-21(28-24)13-14-31-15-17-32(18-16-31)23(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,23H,13-18H2,1-2H3,(H,27,28)