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

Systemtic Name: 1,3-dimethyl-7-[5-(5-methyl-1,2,4-oxadiazol-3-yl)pentyl]purine-2,6-dione Openeye Name: 1,3-dimethyl-7-[5-(5-methyl-1,2,4-oxadiazol-3-yl)pentyl]purine-2,6-dione CAS Name: 1,3-dimethyl-7-[5-(5-methyl-1,2,4-oxadiazol-3-yl)pentyl]purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[5-(5-methyl-1,2,4-oxadiazol-3-yl)pentyl]purine-2,6-dione Traditional Name: 1,3-dimethyl-7-[5-(5-methyl-1,2,4-oxadiazol-3-yl)pentyl]xanthine Formula: C15H20N6O3 MolecularWeight: 332.3577

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NO1)CCCCCN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=NC(=NO1)CCCCCN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C15H20N6O3/c1-10-17-11(18-24-10)7-5-4-6-8-21-9-16-13-12(21)14(22)20(3)15(23)19(13)2/h9H,4-8H2,1-3H3