dimethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-5-(2-pyridin-2-ylsulfanylethanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-5-(2-pyridin-2-ylsulfanylethanoylamino)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-(2-methoxy-2-oxo-ethyl)-5-[[2-(2-pyridylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-(2-methoxy-2-oxoethyl)-5-[[1-oxo-2-(2-pyridinylthio)ethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(2-methoxy-2-oxoethyl)-5-[(2-pyridin-2-ylsulfanylacetyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-(2-keto-2-methoxy-ethyl)-5-[[2-(2-pyridylthio)acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H18N2O7S2 MolecularWeight: 438.47472

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=CC=CC=N2)C(=O)OC

Isomeric SMILES

COC(=O)CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=CC=CC=N2)C(=O)OC

InChI

InChI=1S/C18H18N2O7S2/c1-25-13(22)8-10-14(17(23)26-2)16(29-15(10)18(24)27-3)20-11(21)9-28-12-6-4-5-7-19-12/h4-7H,8-9H2,1-3H3,(H,20,21)