3-[2-(thiophen-3-ylmethylsulfanyl)ethylsulfamoyl]benzoic acid

Systemtic Name: 3-[2-(thiophen-3-ylmethylsulfanyl)ethylsulfamoyl]benzoic acid Openeye Name: 3-[2-(3-thienylmethylsulfanyl)ethylsulfamoyl]benzoic acid CAS Name: 3-[2-(3-thiophenylmethylthio)ethylsulfamoyl]benzoic acid IUPAC Name: 3-[2-(thiophen-3-ylmethylsulfanyl)ethylsulfamoyl]benzoic acid Traditional Name: 3-[2-(3-thenylthio)ethylsulfamoyl]benzoic acid Formula: C14H15NO4S3 MolecularWeight: 357.4682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NCCSCC2=CSC=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NCCSCC2=CSC=C2)C(=O)O

InChI

InChI=1S/C14H15NO4S3/c16-14(17)12-2-1-3-13(8-12)22(18,19)15-5-7-21-10-11-4-6-20-9-11/h1-4,6,8-9,15H,5,7,10H2,(H,16,17)