4-[2-(2-fluorophenyl)sulfanylethanoyl-methyl-amino]butanoic acid

Systemtic Name: 4-[2-(2-fluorophenyl)sulfanylethanoyl-methyl-amino]butanoic acid Openeye Name: 4-[[2-(2-fluorophenyl)sulfanylacetyl]-methyl-amino]butanoic acid CAS Name: 4-[[2-[(2-fluorophenyl)thio]-1-oxoethyl]-methylamino]butanoic acid IUPAC Name: 4-[[2-(2-fluorophenyl)sulfanylacetyl]-methylamino]butanoic acid Traditional Name: 4-[[2-[(2-fluorophenyl)thio]acetyl]-methyl-amino]butyric acid Formula: C13H16FNO3S MolecularWeight: 285.334443

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)CSC1=CC=CC=C1F

Isomeric SMILES

CN(CCCC(=O)O)C(=O)CSC1=CC=CC=C1F

InChI

InChI=1S/C13H16FNO3S/c1-15(8-4-7-13(17)18)12(16)9-19-11-6-3-2-5-10(11)14/h2-3,5-6H,4,7-9H2,1H3,(H,17,18)