(phenylmethyl) 2-[N-(4-methoxyphenyl)-C-(trifluoromethyl)carbonimidoyl]sulfanylethanoate

Systemtic Name: (phenylmethyl) 2-[N-(4-methoxyphenyl)-C-(trifluoromethyl)carbonimidoyl]sulfanylethanoate Openeye Name: benzyl 2-[N-(4-methoxyphenyl)-C-(trifluoromethyl)carbonimidoyl]sulfanylacetate CAS Name: 2-[[2,2,2-trifluoro-1-(4-methoxyphenyl)iminoethyl]thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[N-(4-methoxyphenyl)-C-(trifluoromethyl)carbonimidoyl]sulfanylacetate Traditional Name: 2-[[N-(4-methoxyphenyl)-C-(trifluoromethyl)carbonimidoyl]thio]acetic acid benzyl ester Formula: C18H16F3NO3S MolecularWeight: 383.38475

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C(C(F)(F)F)SCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)N=C(C(F)(F)F)SCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H16F3NO3S/c1-24-15-9-7-14(8-10-15)22-17(18(19,20)21)26-12-16(23)25-11-13-5-3-2-4-6-13/h2-10H,11-12H2,1H3