5-(diphenylsulfamoyl)-2-(phenylmethylsulfanyl)benzoic acid

Systemtic Name: 5-(diphenylsulfamoyl)-2-(phenylmethylsulfanyl)benzoic acid Openeye Name: 2-benzylsulfanyl-5-(diphenylsulfamoyl)benzoic acid CAS Name: 5-(diphenylsulfamoyl)-2-(phenylmethylthio)benzoic acid IUPAC Name: 2-benzylsulfanyl-5-(diphenylsulfamoyl)benzoic acid Traditional Name: 2-(benzylthio)-5-(diphenylsulfamoyl)benzoic acid Formula: C26H21NO4S2 MolecularWeight: 475.57924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C=C(C=C2)S(=O)(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C=C(C=C2)S(=O)(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H21NO4S2/c28-26(29)24-18-23(16-17-25(24)32-19-20-10-4-1-5-11-20)33(30,31)27(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-18H,19H2,(H,28,29)