diethyl 3-methyl-5-[2-(4-methylphenyl)sulfonylethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-(4-methylphenyl)sulfonylethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-(p-tolylsulfonyl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(4-methylphenyl)sulfonyl-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-(4-methylphenyl)sulfonylacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(2-tosylacetyl)amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H23NO7S2 MolecularWeight: 453.52912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H23NO7S2/c1-5-27-19(23)16-13(4)17(20(24)28-6-2)29-18(16)21-15(22)11-30(25,26)14-9-7-12(3)8-10-14/h7-10H,5-6,11H2,1-4H3,(H,21,22)