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

Systemtic Name: 7-[[4-(3-methoxy-3-methyl-butyl)-5-oxidanylidene-1,3,4-oxadiazol-2-yl]methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[[4-(3-methoxy-3-methyl-butyl)-5-oxo-1,3,4-oxadiazol-2-yl]methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[[4-(3-methoxy-3-methylbutyl)-5-oxo-1,3,4-oxadiazol-2-yl]methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[[4-(3-methoxy-3-methylbutyl)-5-oxo-1,3,4-oxadiazol-2-yl]methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[[5-keto-4-(3-methoxy-3-methyl-butyl)-1,3,4-oxadiazol-2-yl]methyl]-1,3-dimethyl-xanthine Formula: C16H22N6O5 MolecularWeight: 378.38308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C(=O)OC(=N1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C)OC

Isomeric SMILES

CC(C)(CCN1C(=O)OC(=N1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C)OC

InChI

InChI=1S/C16H22N6O5/c1-16(2,26-5)6-7-22-15(25)27-10(18-22)8-21-9-17-12-11(21)13(23)20(4)14(24)19(12)3/h9H,6-8H2,1-5H3