[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 2-fluoranyl-5-(methylsulfamoyl)benzoate

Systemtic Name: [2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 2-fluoranyl-5-(methylsulfamoyl)benzoate Openeye Name: [2-(3-methylsulfanylanilino)-2-oxo-ethyl] 2-fluoro-5-(methylsulfamoyl)benzoate CAS Name: 2-fluoro-5-(methylsulfamoyl)benzoic acid [2-[3-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfanylanilino)-2-oxoethyl] 2-fluoro-5-(methylsulfamoyl)benzoate Traditional Name: 2-fluoro-5-(methylsulfamoyl)benzoic acid [2-keto-2-[3-(methylthio)anilino]ethyl] ester Formula: C17H17FN2O5S2 MolecularWeight: 412.455683

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCC(=O)NC2=CC(=CC=C2)SC

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCC(=O)NC2=CC(=CC=C2)SC

InChI

InChI=1S/C17H17FN2O5S2/c1-19-27(23,24)13-6-7-15(18)14(9-13)17(22)25-10-16(21)20-11-4-3-5-12(8-11)26-2/h3-9,19H,10H2,1-2H3,(H,20,21)