dimethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-5-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-5-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-(2-methoxy-2-oxo-ethyl)-5-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-(2-methoxy-2-oxoethyl)-5-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(2-methoxy-2-oxoethyl)-5-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-(2-keto-2-methoxy-ethyl)-5-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H19N3O7S2 MolecularWeight: 441.47866

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=C(C(=C(S2)C(=O)OC)CC(=O)OC)C(=O)OC

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=C(C(=C(S2)C(=O)OC)CC(=O)OC)C(=O)OC

InChI

InChI=1S/C17H19N3O7S2/c1-20-6-5-18-17(20)28-8-10(21)19-14-12(15(23)26-3)9(7-11(22)25-2)13(29-14)16(24)27-4/h5-6H,7-8H2,1-4H3,(H,19,21)