8-methyl-1-(5-pentyl-1,2,4-oxadiazol-3-yl)purine-2,6-dione

Systemtic Name: 8-methyl-1-(5-pentyl-1,2,4-oxadiazol-3-yl)purine-2,6-dione Openeye Name: 8-methyl-1-(5-pentyl-1,2,4-oxadiazol-3-yl)purine-2,6-dione CAS Name: 8-methyl-1-(5-pentyl-1,2,4-oxadiazol-3-yl)purine-2,6-dione IUPAC Name: 8-methyl-1-(5-pentyl-1,2,4-oxadiazol-3-yl)purine-2,6-dione Traditional Name: 1-(5-amyl-1,2,4-oxadiazol-3-yl)-8-methyl-xanthine Formula: C13H14N6O3 MolecularWeight: 302.28866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC(=NO1)N2C(=O)C3=NC(=NC3=NC2=O)C

Isomeric SMILES

CCCCCC1=NC(=NO1)N2C(=O)C3=NC(=NC3=NC2=O)C

InChI

InChI=1S/C13H14N6O3/c1-3-4-5-6-8-16-12(18-22-8)19-11(20)9-10(17-13(19)21)15-7(2)14-9/h3-6H2,1-2H3