2-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylamino]-2-methyl-pentanoic acid

Systemtic Name: 2-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylamino]-2-methyl-pentanoic acid Openeye Name: 2-[[2-(difluoromethylsulfanyl)benzoyl]amino]-2-methyl-pentanoic acid CAS Name: 2-[[[2-(difluoromethylthio)phenyl]-oxomethyl]amino]-2-methylpentanoic acid IUPAC Name: 2-[[2-(difluoromethylsulfanyl)benzoyl]amino]-2-methylpentanoic acid Traditional Name: 2-[[2-(difluoromethylthio)benzoyl]amino]-2-methyl-valeric acid Formula: C14H17F2NO3S MolecularWeight: 317.351486

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)NC(=O)C1=CC=CC=C1SC(F)F

Isomeric SMILES

CCCC(C)(C(=O)O)NC(=O)C1=CC=CC=C1SC(F)F

InChI

InChI=1S/C14H17F2NO3S/c1-3-8-14(2,12(19)20)17-11(18)9-6-4-5-7-10(9)21-13(15)16/h4-7,13H,3,8H2,1-2H3,(H,17,18)(H,19,20)