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

Systemtic Name: 1,3-dimethyl-7-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]purine-2,6-dione Openeye Name: 7-[(5-isopropyl-1,2,4-oxadiazol-3-yl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 1,3-dimethyl-7-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]purine-2,6-dione Traditional Name: 7-[(5-isopropyl-1,2,4-oxadiazol-3-yl)methyl]-1,3-dimethyl-xanthine Formula: C13H16N6O3 MolecularWeight: 304.30454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NO1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(C)C1=NC(=NO1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C13H16N6O3/c1-7(2)11-15-8(16-22-11)5-19-6-14-10-9(19)12(20)18(4)13(21)17(10)3/h6-7H,5H2,1-4H3