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

Systemtic Name: 1,3-dimethyl-7-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]purine-2,6-dione Openeye Name: 1,3-dimethyl-7-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]purine-2,6-dione CAS Name: 1,3-dimethyl-7-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]purine-2,6-dione Traditional Name: 1,3-dimethyl-7-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]xanthine Formula: C11H12N6O3 MolecularWeight: 276.25138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NO1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=NC(=NO1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C11H12N6O3/c1-6-13-7(14-20-6)4-17-5-12-9-8(17)10(18)16(3)11(19)15(9)2/h5H,4H2,1-3H3