5-(dimethylsulfamoyl)-2-[(3-methylphenyl)methylsulfanyl]benzoic acid

Systemtic Name: 5-(dimethylsulfamoyl)-2-[(3-methylphenyl)methylsulfanyl]benzoic acid Openeye Name: 5-(dimethylsulfamoyl)-2-(m-tolylmethylsulfanyl)benzoic acid CAS Name: 5-(dimethylsulfamoyl)-2-[(3-methylphenyl)methylthio]benzoic acid IUPAC Name: 5-(dimethylsulfamoyl)-2-[(3-methylphenyl)methylsulfanyl]benzoic acid Traditional Name: 5-(dimethylsulfamoyl)-2-[(3-methylbenzyl)thio]benzoic acid Formula: C17H19NO4S2 MolecularWeight: 365.46706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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