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

Systemtic Name: 2-[[4-(2-methoxy-2-oxidanylidene-ethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[4-(2-methoxy-2-oxo-ethyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(2-methoxy-2-oxoethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[4-(2-methoxy-2-oxoethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(2-keto-2-methoxy-ethyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetate Formula: C11H10N3O4S2- MolecularWeight: 312.3448

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=NN=C1SCC(=O)[O-])C2=CC=CS2

Isomeric SMILES

COC(=O)CN1C(=NN=C1SCC(=O)[O-])C2=CC=CS2

InChI

InChI=1S/C11H11N3O4S2/c1-18-9(17)5-14-10(7-3-2-4-19-7)12-13-11(14)20-6-8(15)16/h2-4H,5-6H2,1H3,(H,15,16)/p-1