2-[2-(4-fluorophenyl)sulfanylethanoylamino]propanoic acid

Systemtic Name: 2-[2-(4-fluorophenyl)sulfanylethanoylamino]propanoic acid Openeye Name: 2-[[2-(4-fluorophenyl)sulfanylacetyl]amino]propanoic acid CAS Name: 2-[[2-[(4-fluorophenyl)thio]-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-[[2-(4-fluorophenyl)sulfanylacetyl]amino]propanoic acid Traditional Name: 2-[[2-[(4-fluorophenyl)thio]acetyl]amino]propionic acid Formula: C11H12FNO3S MolecularWeight: 257.281283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)CSC1=CC=C(C=C1)F

Isomeric SMILES

CC(C(=O)O)NC(=O)CSC1=CC=C(C=C1)F

InChI

InChI=1S/C11H12FNO3S/c1-7(11(15)16)13-10(14)6-17-9-4-2-8(12)3-5-9/h2-5,7H,6H2,1H3,(H,13,14)(H,15,16)