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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)(C(=O)O)NC(=O)C(F)(F)F

Isomeric SMILES

CC(CS)(C(=O)O)NC(=O)C(F)(F)F

InChI

InChI=1S/C6H8F3NO3S/c1-5(2-14,4(12)13)10-3(11)6(7,8)9/h14H,2H2,1H3,(H,10,11)(H,12,13)