[1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 2-chloranyl-5-methylsulfanyl-benzoate

Systemtic Name: [1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 2-chloranyl-5-methylsulfanyl-benzoate Openeye Name: [1-methyl-2-oxo-2-(3-sulfamoylanilino)ethyl] 2-chloro-5-methylsulfanyl-benzoate CAS Name: 2-chloro-5-(methylthio)benzoic acid [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] 2-chloro-5-methylsulfanylbenzoate Traditional Name: 2-chloro-5-(methylthio)benzoic acid [2-keto-1-methyl-2-(3-sulfamoylanilino)ethyl] ester Formula: C17H17ClN2O5S2 MolecularWeight: 428.91028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)OC(=O)C2=C(C=CC(=C2)SC)Cl

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)OC(=O)C2=C(C=CC(=C2)SC)Cl

InChI

InChI=1S/C17H17ClN2O5S2/c1-10(25-17(22)14-9-12(26-2)6-7-15(14)18)16(21)20-11-4-3-5-13(8-11)27(19,23)24/h3-10H,1-2H3,(H,20,21)(H2,19,23,24)