8-[[bis(phenylmethyl)amino]methyl]-7-ethyl-3-methyl-purine-2,6-dione

Systemtic Name: 8-[[bis(phenylmethyl)amino]methyl]-7-ethyl-3-methyl-purine-2,6-dione Openeye Name: 8-[(dibenzylamino)methyl]-7-ethyl-3-methyl-purine-2,6-dione CAS Name: 8-[[bis(phenylmethyl)amino]methyl]-7-ethyl-3-methylpurine-2,6-dione IUPAC Name: 8-[(dibenzylamino)methyl]-7-ethyl-3-methylpurine-2,6-dione Traditional Name: 8-[(dibenzylamino)methyl]-7-ethyl-3-methyl-xanthine Formula: C23H25N5O2 MolecularWeight: 403.4769

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C(=O)NC(=O)N2C)CN(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCN1C(=NC2=C1C(=O)NC(=O)N2C)CN(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N5O2/c1-3-28-19(24-21-20(28)22(29)25-23(30)26(21)2)16-27(14-17-10-6-4-7-11-17)15-18-12-8-5-9-13-18/h4-13H,3,14-16H2,1-2H3,(H,25,29,30)