5-[bis(phenylmethyl)sulfamoyl]-2-[(4-fluorophenyl)methylsulfanyl]benzoic acid

Systemtic Name: 5-[bis(phenylmethyl)sulfamoyl]-2-[(4-fluorophenyl)methylsulfanyl]benzoic acid Openeye Name: 5-(dibenzylsulfamoyl)-2-[(4-fluorophenyl)methylsulfanyl]benzoic acid CAS Name: 5-[bis(phenylmethyl)sulfamoyl]-2-[(4-fluorophenyl)methylthio]benzoic acid IUPAC Name: 5-(dibenzylsulfamoyl)-2-[(4-fluorophenyl)methylsulfanyl]benzoic acid Traditional Name: 5-(dibenzylsulfamoyl)-2-[(4-fluorobenzyl)thio]benzoic acid Formula: C28H24FNO4S2 MolecularWeight: 521.622863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)SCC4=CC=C(C=C4)F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)SCC4=CC=C(C=C4)F)C(=O)O

InChI

InChI=1S/C28H24FNO4S2/c29-24-13-11-23(12-14-24)20-35-27-16-15-25(17-26(27)28(31)32)36(33,34)30(18-21-7-3-1-4-8-21)19-22-9-5-2-6-10-22/h1-17H,18-20H2,(H,31,32)