2-[[4-chloranyl-3-(trifluoromethyl)pyrazol-1-yl]methylsulfanyl]ethanoate

Systemtic Name: 2-[[4-chloranyl-3-(trifluoromethyl)pyrazol-1-yl]methylsulfanyl]ethanoate Openeye Name: 2-[[4-chloro-3-(trifluoromethyl)pyrazol-1-yl]methylsulfanyl]acetate CAS Name: 2-[[4-chloro-3-(trifluoromethyl)-1-pyrazolyl]methylthio]acetate IUPAC Name: 2-[[4-chloro-3-(trifluoromethyl)pyrazol-1-yl]methylsulfanyl]acetate Traditional Name: 2-[[4-chloro-3-(trifluoromethyl)pyrazol-1-yl]methylthio]acetate Formula: C7H5ClF3N2O2S- MolecularWeight: 273.64001

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NN1CSCC(=O)[O-])C(F)(F)F)Cl

Isomeric SMILES

C1=C(C(=NN1CSCC(=O)[O-])C(F)(F)F)Cl

InChI

InChI=1S/C7H6ClF3N2O2S/c8-4-1-13(3-16-2-5(14)15)12-6(4)7(9,10)11/h1H,2-3H2,(H,14,15)/p-1