3-(dimethylsulfamoyl)-5-[(4-methylphenyl)methylsulfanyl]benzoic acid

Systemtic Name: 3-(dimethylsulfamoyl)-5-[(4-methylphenyl)methylsulfanyl]benzoic acid Openeye Name: 3-(dimethylsulfamoyl)-5-(p-tolylmethylsulfanyl)benzoic acid CAS Name: 3-(dimethylsulfamoyl)-5-[(4-methylphenyl)methylthio]benzoic acid IUPAC Name: 3-(dimethylsulfamoyl)-5-[(4-methylphenyl)methylsulfanyl]benzoic acid Traditional Name: 3-(dimethylsulfamoyl)-5-[(4-methylbenzyl)thio]benzoic acid Formula: C17H19NO4S2 MolecularWeight: 365.46706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=CC(=CC(=C2)C(=O)O)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=CC(=CC(=C2)C(=O)O)S(=O)(=O)N(C)C

InChI

InChI=1S/C17H19NO4S2/c1-12-4-6-13(7-5-12)11-23-15-8-14(17(19)20)9-16(10-15)24(21,22)18(2)3/h4-10H,11H2,1-3H3,(H,19,20)