methyl 2-(2-methoxy-2-oxidanylidene-ethyl)-5-(4-methoxyphenyl)-3H-1,3,4-thiadiazole-2-carboxylate

Systemtic Name: methyl 2-(2-methoxy-2-oxidanylidene-ethyl)-5-(4-methoxyphenyl)-3H-1,3,4-thiadiazole-2-carboxylate Openeye Name: methyl 2-(2-methoxy-2-oxo-ethyl)-5-(4-methoxyphenyl)-3H-1,3,4-thiadiazole-2-carboxylate CAS Name: 2-(2-methoxy-2-oxoethyl)-5-(4-methoxyphenyl)-3H-1,3,4-thiadiazole-2-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-methoxy-2-oxoethyl)-5-(4-methoxyphenyl)-3H-1,3,4-thiadiazole-2-carboxylate Traditional Name: 2-(2-keto-2-methoxy-ethyl)-5-(4-methoxyphenyl)-3H-1,3,4-thiadiazole-2-carboxylic acid methyl ester Formula: C14H16N2O5S MolecularWeight: 324.35224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(S2)(CC(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(S2)(CC(=O)OC)C(=O)OC

InChI

InChI=1S/C14H16N2O5S/c1-19-10-6-4-9(5-7-10)12-15-16-14(22-12,13(18)21-3)8-11(17)20-2/h4-7,16H,8H2,1-3H3