ethyl 4-ethyl-5-methyl-2-[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-[[2-[3-(p-tolylsulfonyl)propanoyloxy]acetyl]amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[2-[3-(4-methylphenyl)sulfonyl-1-oxopropoxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-[[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[[2-(3-tosylpropanoyloxy)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H27NO7S2 MolecularWeight: 481.58228

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C)C

InChI

InChI=1S/C22H27NO7S2/c1-5-17-15(4)31-21(20(17)22(26)29-6-2)23-18(24)13-30-19(25)11-12-32(27,28)16-9-7-14(3)8-10-16/h7-10H,5-6,11-13H2,1-4H3,(H,23,24)