3-methylsulfanyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]propanoic acid

Systemtic Name: 3-methylsulfanyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]propanoic acid Openeye Name: 3-methylsulfanyl-2-[(2,2,2-trifluoroacetyl)amino]propanoic acid CAS Name: 3-(methylthio)-2-[(2,2,2-trifluoro-1-oxoethyl)amino]propanoic acid IUPAC Name: 3-methylsulfanyl-2-[(2,2,2-trifluoroacetyl)amino]propanoic acid Traditional Name: 3-(methylthio)-2-[(2,2,2-trifluoroacetyl)amino]propionic acid Formula: C6H8F3NO3S MolecularWeight: 231.19283

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)O)NC(=O)C(F)(F)F

Isomeric SMILES

CSCC(C(=O)O)NC(=O)C(F)(F)F

InChI

InChI=1S/C6H8F3NO3S/c1-14-2-3(4(11)12)10-5(13)6(7,8)9/h3H,2H2,1H3,(H,10,13)(H,11,12)