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

Systemtic Name: 7-[[5-(2-hydroxyethyl)-1,2,4-oxadiazol-3-yl]methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[[5-(2-hydroxyethyl)-1,2,4-oxadiazol-3-yl]methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[[5-(2-hydroxyethyl)-1,2,4-oxadiazol-3-yl]methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[[5-(2-hydroxyethyl)-1,2,4-oxadiazol-3-yl]methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[[5-(2-hydroxyethyl)-1,2,4-oxadiazol-3-yl]methyl]-1,3-dimethyl-xanthine Formula: C12H14N6O4 MolecularWeight: 306.27736

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC3=NOC(=N3)CCO

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC3=NOC(=N3)CCO

InChI

InChI=1S/C12H14N6O4/c1-16-10-9(11(20)17(2)12(16)21)18(6-13-10)5-7-14-8(3-4-19)22-15-7/h6,19H,3-5H2,1-2H3