1,3-dimethyl-7-[2-(5-pentyl-1,2,4-oxadiazol-3-yl)ethyl]purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-[2-(5-pentyl-1,2,4-oxadiazol-3-yl)ethyl]purine-2,6-dione Openeye Name: 1,3-dimethyl-7-[2-(5-pentyl-1,2,4-oxadiazol-3-yl)ethyl]purine-2,6-dione CAS Name: 1,3-dimethyl-7-[2-(5-pentyl-1,2,4-oxadiazol-3-yl)ethyl]purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[2-(5-pentyl-1,2,4-oxadiazol-3-yl)ethyl]purine-2,6-dione Traditional Name: 7-[2-(5-amyl-1,2,4-oxadiazol-3-yl)ethyl]-1,3-dimethyl-xanthine Formula: C16H22N6O3 MolecularWeight: 346.38428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC(=NO1)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCCCCC1=NC(=NO1)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C16H22N6O3/c1-4-5-6-7-12-18-11(19-25-12)8-9-22-10-17-14-13(22)15(23)21(3)16(24)20(14)2/h10H,4-9H2,1-3H3