5-[2-[4-(4-fluoranylphenoxy)phenyl]sulfanylethylsulfamoyl]-2,3-dimethyl-benzoic acid

Systemtic Name: 5-[2-[4-(4-fluoranylphenoxy)phenyl]sulfanylethylsulfamoyl]-2,3-dimethyl-benzoic acid Openeye Name: 5-[2-[4-(4-fluorophenoxy)phenyl]sulfanylethylsulfamoyl]-2,3-dimethyl-benzoic acid CAS Name: 5-[2-[[4-(4-fluorophenoxy)phenyl]thio]ethylsulfamoyl]-2,3-dimethylbenzoic acid IUPAC Name: 5-[2-[4-(4-fluorophenoxy)phenyl]sulfanylethylsulfamoyl]-2,3-dimethylbenzoic acid Traditional Name: 5-[2-[[4-(4-fluorophenoxy)phenyl]thio]ethylsulfamoyl]-2,3-dimethyl-benzoic acid Formula: C23H22FNO5S2 MolecularWeight: 475.552883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)S(=O)(=O)NCCSC2=CC=C(C=C2)OC3=CC=C(C=C3)F)C(=O)O)C

Isomeric SMILES

CC1=C(C(=CC(=C1)S(=O)(=O)NCCSC2=CC=C(C=C2)OC3=CC=C(C=C3)F)C(=O)O)C

InChI

InChI=1S/C23H22FNO5S2/c1-15-13-21(14-22(16(15)2)23(26)27)32(28,29)25-11-12-31-20-9-7-19(8-10-20)30-18-5-3-17(24)4-6-18/h3-10,13-14,25H,11-12H2,1-2H3,(H,26,27)