ethyl (2R)-2-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]carbonylamino]-3-sulfanyl-propanoate

Systemtic Name: ethyl (2R)-2-[[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]carbonylamino]-3-sulfanyl-propanoate Openeye Name: ethyl (2R)-2-[[1-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]-3-sulfanyl-propanoate CAS Name: (2R)-3-mercapto-2-[[[1-methyl-5-(trifluoromethyl)-3-pyrazolyl]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-[[1-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]-3-sulfanylpropanoate Traditional Name: (2R)-3-mercapto-2-[[1-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]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)C1=NN(C(=C1)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)[C@H](CS)NC(=O)C1=NN(C(=C1)C(F)(F)F)C

InChI

InChI=1S/C11H14F3N3O3S/c1-3-20-10(19)7(5-21)15-9(18)6-4-8(11(12,13)14)17(2)16-6/h4,7,21H,3,5H2,1-2H3,(H,15,18)/t7-/m0/s1