7-butyl-1-ethyl-8-methyl-3-propyl-purine-2,6-dione

Systemtic Name: 7-butyl-1-ethyl-8-methyl-3-propyl-purine-2,6-dione Openeye Name: 7-butyl-1-ethyl-8-methyl-3-propyl-purine-2,6-dione CAS Name: 7-butyl-1-ethyl-8-methyl-3-propylpurine-2,6-dione IUPAC Name: 7-butyl-1-ethyl-8-methyl-3-propylpurine-2,6-dione Traditional Name: 7-butyl-1-ethyl-8-methyl-3-propyl-xanthine Formula: C15H24N4O2 MolecularWeight: 292.37666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C1C(=O)N(C(=O)N2CCC)CC)C

Isomeric SMILES

CCCCN1C(=NC2=C1C(=O)N(C(=O)N2CCC)CC)C

InChI

InChI=1S/C15H24N4O2/c1-5-8-10-18-11(4)16-13-12(18)14(20)17(7-3)15(21)19(13)9-6-2/h5-10H2,1-4H3