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

Systemtic Name: 7-[[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]methyl]-3-methyl-purine-2,6-dione Openeye Name: 7-[[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]methyl]-3-methyl-purine-2,6-dione CAS Name: 7-[[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]methyl]-3-methylpurine-2,6-dione IUPAC Name: 7-[[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]methyl]-3-methylpurine-2,6-dione Traditional Name: 7-[[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]methyl]-3-methyl-xanthine Formula: C10H9ClN6O3 MolecularWeight: 296.66986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C=N2)CC3=NOC(=N3)CCl

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C=N2)CC3=NOC(=N3)CCl

InChI

InChI=1S/C10H9ClN6O3/c1-16-8-7(9(18)14-10(16)19)17(4-12-8)3-5-13-6(2-11)20-15-5/h4H,2-3H2,1H3,(H,14,18,19)