7-methyl-8-(2-methylpropyl)-3H-purine-2,6-dione

Systemtic Name: 7-methyl-8-(2-methylpropyl)-3H-purine-2,6-dione Openeye Name: 8-isobutyl-7-methyl-3H-purine-2,6-dione CAS Name: 7-methyl-8-(2-methylpropyl)-3H-purine-2,6-dione IUPAC Name: 7-methyl-8-(2-methylpropyl)-3H-purine-2,6-dione Traditional Name: 8-isobutyl-7-methyl-xanthine Formula: C10H14N4O2 MolecularWeight: 222.24376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC2=C(N1C)C(=O)NC(=O)N2

Isomeric SMILES

CC(C)CC1=NC2=C(N1C)C(=O)NC(=O)N2

InChI

InChI=1S/C10H14N4O2/c1-5(2)4-6-11-8-7(14(6)3)9(15)13-10(16)12-8/h5H,4H2,1-3H3,(H2,12,13,15,16)