2-[2-(2-fluorophenyl)sulfanylethanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2-(2-fluorophenyl)sulfanylethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-(2-fluorophenyl)sulfanylacetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-[(2-fluorophenyl)thio]-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-(2-fluorophenyl)sulfanylacetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-[(2-fluorophenyl)thio]acetyl]amino]-4-(methylthio)butyric acid Formula: C13H16FNO3S2 MolecularWeight: 317.399443

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)CSC1=CC=CC=C1F

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)CSC1=CC=CC=C1F

InChI

InChI=1S/C13H16FNO3S2/c1-19-7-6-10(13(17)18)15-12(16)8-20-11-5-3-2-4-9(11)14/h2-5,10H,6-8H2,1H3,(H,15,16)(H,17,18)