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

Systemtic Name: 3-methyl-8-(methylamino)-7-(2-methylpropyl)purine-2,6-dione Openeye Name: 7-isobutyl-3-methyl-8-(methylamino)purine-2,6-dione CAS Name: 3-methyl-8-(methylamino)-7-(2-methylpropyl)purine-2,6-dione IUPAC Name: 3-methyl-8-(methylamino)-7-(2-methylpropyl)purine-2,6-dione Traditional Name: 7-isobutyl-3-methyl-8-(methylamino)xanthine Formula: C11H17N5O2 MolecularWeight: 251.28498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(N=C1NC)N(C(=O)NC2=O)C

Isomeric SMILES

CC(C)CN1C2=C(N=C1NC)N(C(=O)NC2=O)C

InChI

InChI=1S/C11H17N5O2/c1-6(2)5-16-7-8(13-10(16)12-3)15(4)11(18)14-9(7)17/h6H,5H2,1-4H3,(H,12,13)(H,14,17,18)