2,4-bis(chloranyl)-5-[2-(thiophen-3-ylmethylsulfanyl)ethylsulfamoyl]benzoic acid

Systemtic Name: 2,4-bis(chloranyl)-5-[2-(thiophen-3-ylmethylsulfanyl)ethylsulfamoyl]benzoic acid Openeye Name: 2,4-dichloro-5-[2-(3-thienylmethylsulfanyl)ethylsulfamoyl]benzoic acid CAS Name: 2,4-dichloro-5-[2-(3-thiophenylmethylthio)ethylsulfamoyl]benzoic acid IUPAC Name: 2,4-dichloro-5-[2-(thiophen-3-ylmethylsulfanyl)ethylsulfamoyl]benzoic acid Traditional Name: 2,4-dichloro-5-[2-(3-thenylthio)ethylsulfamoyl]benzoic acid Formula: C14H13Cl2NO4S3 MolecularWeight: 426.35832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1CSCCNS(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl

Isomeric SMILES

C1=CSC=C1CSCCNS(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl

InChI

InChI=1S/C14H13Cl2NO4S3/c15-11-6-12(16)13(5-10(11)14(18)19)24(20,21)17-2-4-23-8-9-1-3-22-7-9/h1,3,5-7,17H,2,4,8H2,(H,18,19)