4-sulfanyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoic acid

Systemtic Name: 4-sulfanyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoic acid Openeye Name: 4-sulfanyl-2-[(2,2,2-trifluoroacetyl)amino]butanoic acid CAS Name: 4-mercapto-2-[(2,2,2-trifluoro-1-oxoethyl)amino]butanoic acid IUPAC Name: 4-sulfanyl-2-[(2,2,2-trifluoroacetyl)amino]butanoic acid Traditional Name: 4-mercapto-2-[(2,2,2-trifluoroacetyl)amino]butyric acid Formula: C6H8F3NO3S MolecularWeight: 231.19283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H8F3NO3S/c7-6(8,9)5(13)10-3(1-2-14)4(11)12/h3,14H,1-2H2,(H,10,13)(H,11,12)