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

Systemtic Name: 3-(diphenylsulfamoyl)-5-(phenylmethylsulfanyl)benzoic acid Openeye Name: 3-benzylsulfanyl-5-(diphenylsulfamoyl)benzoic acid CAS Name: 3-(diphenylsulfamoyl)-5-(phenylmethylthio)benzoic acid IUPAC Name: 3-benzylsulfanyl-5-(diphenylsulfamoyl)benzoic acid Traditional Name: 3-(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=CC(=CC(=C2)C(=O)O)S(=O)(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

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

InChI

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