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

Systemtic Name: dimethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-5-[2-(4-methylphenyl)sulfanylethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-(2-methoxy-2-oxo-ethyl)-5-[[2-(p-tolylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-(2-methoxy-2-oxoethyl)-5-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(2-methoxy-2-oxoethyl)-5-[[2-(4-methylphenyl)sulfanylacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-(2-keto-2-methoxy-ethyl)-5-[[2-(p-tolylthio)acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C20H21NO7S2 MolecularWeight: 451.51324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=C(C(=C(S2)C(=O)OC)CC(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=C(C(=C(S2)C(=O)OC)CC(=O)OC)C(=O)OC

InChI

InChI=1S/C20H21NO7S2/c1-11-5-7-12(8-6-11)29-10-14(22)21-18-16(19(24)27-3)13(9-15(23)26-2)17(30-18)20(25)28-4/h5-8H,9-10H2,1-4H3,(H,21,22)