1,3-dicyclopropyl-7-methyl-purine-2,6-dione

Systemtic Name: 1,3-dicyclopropyl-7-methyl-purine-2,6-dione Openeye Name: 1,3-dicyclopropyl-7-methyl-purine-2,6-dione CAS Name: 1,3-dicyclopropyl-7-methylpurine-2,6-dione IUPAC Name: 1,3-dicyclopropyl-7-methylpurine-2,6-dione Traditional Name: 1,3-dicyclopropyl-7-methyl-xanthine Formula: C12H14N4O2 MolecularWeight: 246.26516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C3CC3)C4CC4

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C3CC3)C4CC4

InChI

InChI=1S/C12H14N4O2/c1-14-6-13-10-9(14)11(17)16(8-4-5-8)12(18)15(10)7-2-3-7/h6-8H,2-5H2,1H3