S-[[2-[1,1-bis(fluoranyl)hex-1-en-2-yl]phenyl]methyl] ethanethioate

Systemtic Name: S-[[2-[1,1-bis(fluoranyl)hex-1-en-2-yl]phenyl]methyl] ethanethioate Openeye Name: S-[[2-[1-(difluoromethylene)pentyl]phenyl]methyl] ethanethioate CAS Name: ethanethioic acid S-[[2-(1,1-difluorohex-1-en-2-yl)phenyl]methyl] ester IUPAC Name: S-[[2-(1,1-difluorohex-1-en-2-yl)phenyl]methyl] ethanethioate Traditional Name: ethanethioic acid S-[2-(1-butyl-2,2-difluoro-vinyl)benzyl] ester Formula: C15H18F2OS MolecularWeight: 284.364626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C(F)F)C1=CC=CC=C1CSC(=O)C

Isomeric SMILES

CCCCC(=C(F)F)C1=CC=CC=C1CSC(=O)C

InChI

InChI=1S/C15H18F2OS/c1-3-4-8-14(15(16)17)13-9-6-5-7-12(13)10-19-11(2)18/h5-7,9H,3-4,8,10H2,1-2H3