methyl 4-[(2-methylsulfanylphenyl)sulfamoylmethyl]benzoate

Systemtic Name: methyl 4-[(2-methylsulfanylphenyl)sulfamoylmethyl]benzoate Openeye Name: methyl 4-[(2-methylsulfanylphenyl)sulfamoylmethyl]benzoate CAS Name: 4-[[2-(methylthio)phenyl]sulfamoylmethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-methylsulfanylphenyl)sulfamoylmethyl]benzoate Traditional Name: 4-[[2-(methylthio)phenyl]sulfamoylmethyl]benzoic acid methyl ester Formula: C16H17NO4S2 MolecularWeight: 351.44048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)NC2=CC=CC=C2SC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)NC2=CC=CC=C2SC

InChI

InChI=1S/C16H17NO4S2/c1-21-16(18)13-9-7-12(8-10-13)11-23(19,20)17-14-5-3-4-6-15(14)22-2/h3-10,17H,11H2,1-2H3