8-[[2,5-bis(oxidanylidene)-4,4-diphenyl-imidazolidin-1-yl]methyl]-3-butyl-7-methyl-purine-2,6-dione

Systemtic Name: 8-[[2,5-bis(oxidanylidene)-4,4-diphenyl-imidazolidin-1-yl]methyl]-3-butyl-7-methyl-purine-2,6-dione Openeye Name: 3-butyl-8-[(2,5-dioxo-4,4-diphenyl-imidazolidin-1-yl)methyl]-7-methyl-purine-2,6-dione CAS Name: 3-butyl-8-[(2,5-dioxo-4,4-diphenyl-1-imidazolidinyl)methyl]-7-methylpurine-2,6-dione IUPAC Name: 3-butyl-8-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-7-methylpurine-2,6-dione Traditional Name: 3-butyl-8-[(2,5-diketo-4,4-diphenyl-imidazolidin-1-yl)methyl]-7-methyl-xanthine Formula: C26H26N6O4 MolecularWeight: 486.52244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CN3C(=O)C(NC3=O)(C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CN3C(=O)C(NC3=O)(C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C26H26N6O4/c1-3-4-15-31-21-20(22(33)28-24(31)35)30(2)19(27-21)16-32-23(34)26(29-25(32)36,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3,(H,29,36)(H,28,33,35)