ethyl (2R)-3-sulfanyl-2-[2-[3-(trifluoromethyl)pyrazol-1-yl]ethanoylamino]propanoate

Systemtic Name: ethyl (2R)-3-sulfanyl-2-[2-[3-(trifluoromethyl)pyrazol-1-yl]ethanoylamino]propanoate Openeye Name: ethyl (2R)-3-sulfanyl-2-[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]propanoate CAS Name: (2R)-3-mercapto-2-[[1-oxo-2-[3-(trifluoromethyl)-1-pyrazolyl]ethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2R)-3-sulfanyl-2-[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]propanoate Traditional Name: (2R)-3-mercapto-2-[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]propionic acid ethyl ester Formula: C11H14F3N3O3S MolecularWeight: 325.30737

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)NC(=O)CN1C=CC(=N1)C(F)(F)F

Isomeric SMILES

CCOC(=O)[C@H](CS)NC(=O)CN1C=CC(=N1)C(F)(F)F

InChI

InChI=1S/C11H14F3N3O3S/c1-2-20-10(19)7(6-21)15-9(18)5-17-4-3-8(16-17)11(12,13)14/h3-4,7,21H,2,5-6H2,1H3,(H,15,18)/t7-/m0/s1