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

Systemtic Name: 3-methyl-8-(methylamino)-7-pentyl-purine-2,6-dione Openeye Name: 3-methyl-8-(methylamino)-7-pentyl-purine-2,6-dione CAS Name: 3-methyl-8-(methylamino)-7-pentylpurine-2,6-dione IUPAC Name: 3-methyl-8-(methylamino)-7-pentylpurine-2,6-dione Traditional Name: 7-amyl-3-methyl-8-(methylamino)xanthine Formula: C12H19N5O2 MolecularWeight: 265.31156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(N=C1NC)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCN1C2=C(N=C1NC)N(C(=O)NC2=O)C

InChI

InChI=1S/C12H19N5O2/c1-4-5-6-7-17-8-9(14-11(17)13-2)16(3)12(19)15-10(8)18/h4-7H2,1-3H3,(H,13,14)(H,15,18,19)