4-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylamino]-3-methyl-benzoic acid Openeye Name: 4-[[2-(difluoromethylsulfanyl)benzoyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[[2-(difluoromethylthio)phenyl]-oxomethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[2-(difluoromethylsulfanyl)benzoyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[2-(difluoromethylthio)benzoyl]amino]-3-methyl-benzoic acid Formula: C16H13F2NO3S MolecularWeight: 337.341126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC=CC=C2SC(F)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC=CC=C2SC(F)F

InChI

InChI=1S/C16H13F2NO3S/c1-9-8-10(15(21)22)6-7-12(9)19-14(20)11-4-2-3-5-13(11)23-16(17)18/h2-8,16H,1H3,(H,19,20)(H,21,22)