3-[2,4-bis(fluoranyl)phenyl]sulfanyl-4-(methylsulfonylamino)benzoic acid

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]sulfanyl-4-(methylsulfonylamino)benzoic acid Openeye Name: 3-(2,4-difluorophenyl)sulfanyl-4-(methanesulfonamido)benzoic acid CAS Name: 3-[(2,4-difluorophenyl)thio]-4-(methanesulfonamido)benzoic acid IUPAC Name: 3-(2,4-difluorophenyl)sulfanyl-4-(methanesulfonamido)benzoic acid Traditional Name: 3-[(2,4-difluorophenyl)thio]-4-(methanesulfonamido)benzoic acid Formula: C14H11F2NO4S2 MolecularWeight: 359.368246

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=C(C=C1)C(=O)O)SC2=C(C=C(C=C2)F)F

Isomeric SMILES

CS(=O)(=O)NC1=C(C=C(C=C1)C(=O)O)SC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C14H11F2NO4S2/c1-23(20,21)17-11-4-2-8(14(18)19)6-13(11)22-12-5-3-9(15)7-10(12)16/h2-7,17H,1H3,(H,18,19)