diethyl 3-methyl-5-[2-(4-propan-2-ylsulfonylphenyl)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-(4-propan-2-ylsulfonylphenyl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[2-(4-isopropylsulfonylphenyl)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-(4-propan-2-ylsulfonylphenyl)ethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-(4-propan-2-ylsulfonylphenyl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(4-isopropylsulfonylphenyl)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H27NO7S2 MolecularWeight: 481.58228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CC2=CC=C(C=C2)S(=O)(=O)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CC2=CC=C(C=C2)S(=O)(=O)C(C)C

InChI

InChI=1S/C22H27NO7S2/c1-6-29-21(25)18-14(5)19(22(26)30-7-2)31-20(18)23-17(24)12-15-8-10-16(11-9-15)32(27,28)13(3)4/h8-11,13H,6-7,12H2,1-5H3,(H,23,24)