O-ethyl [5-[2,4-bis(fluoranyl)phenyl]-1-ethoxy-5-oxidanylidene-pentan-2-yl]sulfanylmethanethioate

Systemtic Name: O-ethyl [5-[2,4-bis(fluoranyl)phenyl]-1-ethoxy-5-oxidanylidene-pentan-2-yl]sulfanylmethanethioate Openeye Name: O-ethyl [4-(2,4-difluorophenyl)-1-(ethoxymethyl)-4-oxo-butyl]sulfanylmethanethioate CAS Name: [[5-(2,4-difluorophenyl)-1-ethoxy-5-oxopentan-2-yl]thio]methanethioic acid O-ethyl ester IUPAC Name: O-ethyl [5-(2,4-difluorophenyl)-1-ethoxy-5-oxopentan-2-yl]sulfanylmethanethioate Traditional Name: [[4-(2,4-difluorophenyl)-1-(ethoxymethyl)-4-keto-butyl]thio]methanethioic acid O-ethyl ester Formula: C16H20F2O3S2 MolecularWeight: 362.455006

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(CCC(=O)C1=C(C=C(C=C1)F)F)SC(=S)OCC

Isomeric SMILES

CCOCC(CCC(=O)C1=C(C=C(C=C1)F)F)SC(=S)OCC

InChI

InChI=1S/C16H20F2O3S2/c1-3-20-10-12(23-16(22)21-4-2)6-8-15(19)13-7-5-11(17)9-14(13)18/h5,7,9,12H,3-4,6,8,10H2,1-2H3