1,3-dimethyl-7-[[methyl-(phenylmethyl)amino]methyl]purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-[[methyl-(phenylmethyl)amino]methyl]purine-2,6-dione Openeye Name: 7-[[benzyl(methyl)amino]methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 1,3-dimethyl-7-[[methyl-(phenylmethyl)amino]methyl]purine-2,6-dione IUPAC Name: 7-[[benzyl(methyl)amino]methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[[benzyl(methyl)amino]methyl]-1,3-dimethyl-xanthine Formula: C16H19N5O2 MolecularWeight: 313.35436

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CN(C)CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CN(C)CC3=CC=CC=C3

InChI

InChI=1S/C16H19N5O2/c1-18(9-12-7-5-4-6-8-12)11-21-10-17-14-13(21)15(22)20(3)16(23)19(14)2/h4-8,10H,9,11H2,1-3H3