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

Systemtic Name: ethyl 5-ethyl-2-[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-[3-(p-tolylsulfonyl)propanoyloxy]acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[2-[3-(4-methylphenyl)sulfonyl-1-oxopropoxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-(3-tosylpropanoyloxy)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO7S2 MolecularWeight: 467.5557

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C)C(=O)OCC

InChI

InChI=1S/C21H25NO7S2/c1-4-15-12-17(21(25)28-5-2)20(30-15)22-18(23)13-29-19(24)10-11-31(26,27)16-8-6-14(3)7-9-16/h6-9,12H,4-5,10-11,13H2,1-3H3,(H,22,23)