ethyl 4-fluoranyl-3-[2-[(4-methylphenyl)sulfonylamino]ethanoyloxymethyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[2-[(4-methylphenyl)sulfonylamino]ethanoyloxymethyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[[2-(p-tolylsulfonylamino)acetyl]oxymethyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[[2-[(4-methylphenyl)sulfonylamino]-1-oxoethoxy]methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[[2-[(4-methylphenyl)sulfonylamino]acetyl]oxymethyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[[2-(tosylamino)acetyl]oxymethyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C21H20FNO6S2 MolecularWeight: 465.515003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)CNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)CNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H20FNO6S2/c1-3-28-21(25)20-15(19-16(22)5-4-6-17(19)30-20)12-29-18(24)11-23-31(26,27)14-9-7-13(2)8-10-14/h4-10,23H,3,11-12H2,1-2H3