methyl 4-[2-[(3-methylphenyl)methylsulfanyl]ethylsulfamoylmethyl]benzoate

Systemtic Name: methyl 4-[2-[(3-methylphenyl)methylsulfanyl]ethylsulfamoylmethyl]benzoate Openeye Name: methyl 4-[2-(m-tolylmethylsulfanyl)ethylsulfamoylmethyl]benzoate CAS Name: 4-[2-[(3-methylphenyl)methylthio]ethylsulfamoylmethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(3-methylphenyl)methylsulfanyl]ethylsulfamoylmethyl]benzoate Traditional Name: 4-[2-[(3-methylbenzyl)thio]ethylsulfamoylmethyl]benzoic acid methyl ester Formula: C19H23NO4S2 MolecularWeight: 393.52022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCCNS(=O)(=O)CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)CSCCNS(=O)(=O)CC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H23NO4S2/c1-15-4-3-5-17(12-15)13-25-11-10-20-26(22,23)14-16-6-8-18(9-7-16)19(21)24-2/h3-9,12,20H,10-11,13-14H2,1-2H3