2-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]sulfonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]sulfonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(2-bromo-4,6-difluoro-phenyl)sulfonylamino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[(2-bromo-4,6-difluorophenyl)sulfonylamino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(2-bromo-4,6-difluorophenyl)sulfonylamino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(2-bromo-4,6-difluoro-phenyl)sulfonylamino]-4-(methylthio)butyric acid Formula: C11H12BrF2NO4S2 MolecularWeight: 404.248086

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NS(=O)(=O)C1=C(C=C(C=C1Br)F)F

Isomeric SMILES

CSCCC(C(=O)O)NS(=O)(=O)C1=C(C=C(C=C1Br)F)F

InChI

InChI=1S/C11H12BrF2NO4S2/c1-20-3-2-9(11(16)17)15-21(18,19)10-7(12)4-6(13)5-8(10)14/h4-5,9,15H,2-3H2,1H3,(H,16,17)