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

Systemtic Name: 3-methyl-7-[3-(5-methyl-1,2,4-oxadiazol-3-yl)propyl]purine-2,6-dione Openeye Name: 3-methyl-7-[3-(5-methyl-1,2,4-oxadiazol-3-yl)propyl]purine-2,6-dione CAS Name: 3-methyl-7-[3-(5-methyl-1,2,4-oxadiazol-3-yl)propyl]purine-2,6-dione IUPAC Name: 3-methyl-7-[3-(5-methyl-1,2,4-oxadiazol-3-yl)propyl]purine-2,6-dione Traditional Name: 3-methyl-7-[3-(5-methyl-1,2,4-oxadiazol-3-yl)propyl]xanthine Formula: C12H14N6O3 MolecularWeight: 290.27796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NO1)CCCN2C=NC3=C2C(=O)NC(=O)N3C

Isomeric SMILES

CC1=NC(=NO1)CCCN2C=NC3=C2C(=O)NC(=O)N3C

InChI

InChI=1S/C12H14N6O3/c1-7-14-8(16-21-7)4-3-5-18-6-13-10-9(18)11(19)15-12(20)17(10)2/h6H,3-5H2,1-2H3,(H,15,19,20)