8-azanyl-7-butyl-3-methyl-purine-2,6-dione

Systemtic Name: 8-azanyl-7-butyl-3-methyl-purine-2,6-dione Openeye Name: 8-amino-7-butyl-3-methyl-purine-2,6-dione CAS Name: 8-amino-7-butyl-3-methylpurine-2,6-dione IUPAC Name: 8-amino-7-butyl-3-methylpurine-2,6-dione Traditional Name: 8-amino-7-butyl-3-methyl-xanthine Formula: C10H15N5O2 MolecularWeight: 237.2584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(N=C1N)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCN1C2=C(N=C1N)N(C(=O)NC2=O)C

InChI

InChI=1S/C10H15N5O2/c1-3-4-5-15-6-7(12-9(15)11)14(2)10(17)13-8(6)16/h3-5H2,1-2H3,(H2,11,12)(H,13,16,17)