2-[2-[[3,5-bis(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[[3,5-bis(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-[3,5-bis(trifluoromethyl)anilino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[3,5-bis(trifluoromethyl)anilino]-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-[3,5-bis(trifluoromethyl)anilino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[3,5-bis(trifluoromethyl)anilino]-2-keto-ethyl]thio]acetate Formula: C12H8F6NO3S- MolecularWeight: 360.252239

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)NC(=O)CSCC(=O)[O-])C(F)(F)F

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)NC(=O)CSCC(=O)[O-])C(F)(F)F

InChI

InChI=1S/C12H9F6NO3S/c13-11(14,15)6-1-7(12(16,17)18)3-8(2-6)19-9(20)4-23-5-10(21)22/h1-3H,4-5H2,(H,19,20)(H,21,22)/p-1