2-[[4-(2-methoxy-2-oxidanylidene-ethyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[4-(2-methoxy-2-oxidanylidene-ethyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[4-(2-methoxy-2-oxo-ethyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(2-methoxy-2-oxoethyl)-5-methyl-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[4-(2-methoxy-2-oxoethyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(2-keto-2-methoxy-ethyl)-5-methyl-1,2,4-triazol-3-yl]thio]acetate Formula: C8H10N3O4S- MolecularWeight: 244.2477

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC(=O)OC)SCC(=O)[O-]

Isomeric SMILES

CC1=NN=C(N1CC(=O)OC)SCC(=O)[O-]

InChI

InChI=1S/C8H11N3O4S/c1-5-9-10-8(16-4-6(12)13)11(5)3-7(14)15-2/h3-4H2,1-2H3,(H,12,13)/p-1