S-methyl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-methylsulfanyl-phenoxy]propanethioate

Systemtic Name: S-methyl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-methylsulfanyl-phenoxy]propanethioate Openeye Name: S-methyl 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-methylsulfanyl-phenoxy]propanethioate CAS Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-(methylthio)phenoxy]propanethioic acid S-methyl ester IUPAC Name: S-methyl 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-methylsulfanylphenoxy]propanethioate Traditional Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-(methylthio)phenoxy]propanethioic acid S-methyl ester Formula: C18H16ClF3O3S2 MolecularWeight: 436.89605

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)SC)OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)SC

Isomeric SMILES

CC(C(=O)SC)OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)SC

InChI

InChI=1S/C18H16ClF3O3S2/c1-10(17(23)27-3)24-15-9-12(5-7-16(15)26-2)25-14-6-4-11(8-13(14)19)18(20,21)22/h4-10H,1-3H3