methyl 2-[2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanylethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanylethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]acetyl]amino]acetic acid methyl ester Formula: C12H11ClF3NO3S MolecularWeight: 341.73385

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CSC1=CC(=C(C=C1)Cl)C(F)(F)F

Isomeric SMILES

COC(=O)CNC(=O)CSC1=CC(=C(C=C1)Cl)C(F)(F)F

InChI

InChI=1S/C12H11ClF3NO3S/c1-20-11(19)5-17-10(18)6-21-7-2-3-9(13)8(4-7)12(14,15)16/h2-4H,5-6H2,1H3,(H,17,18)