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

Systemtic Name: diethyl 3-methyl-5-[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-[3-(p-tolylsulfonyl)propanoyloxy]acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[3-(4-methylphenyl)sulfonyl-1-oxopropoxy]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(3-tosylpropanoyloxy)acetyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C23H27NO9S2 MolecularWeight: 525.59178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO9S2/c1-5-31-22(27)19-15(4)20(23(28)32-6-2)34-21(19)24-17(25)13-33-18(26)11-12-35(29,30)16-9-7-14(3)8-10-16/h7-10H,5-6,11-13H2,1-4H3,(H,24,25)