[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-3-(dimethylsulfamoyl)benzoate

Systemtic Name: [2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-3-(dimethylsulfamoyl)benzoate Openeye Name: [2-(3-methylsulfanylanilino)-2-oxo-ethyl] 4-chloro-3-(dimethylsulfamoyl)benzoate CAS Name: 4-chloro-3-(dimethylsulfamoyl)benzoic acid [2-[3-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfanylanilino)-2-oxoethyl] 4-chloro-3-(dimethylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(dimethylsulfamoyl)benzoic acid [2-keto-2-[3-(methylthio)anilino]ethyl] ester Formula: C18H19ClN2O5S2 MolecularWeight: 442.93686

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)SC)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)SC)Cl

InChI

InChI=1S/C18H19ClN2O5S2/c1-21(2)28(24,25)16-9-12(7-8-15(16)19)18(23)26-11-17(22)20-13-5-4-6-14(10-13)27-3/h4-10H,11H2,1-3H3,(H,20,22)