3-methyl-4-[2-(trifluoromethylsulfanyl)phenoxy]azepane

Systemtic Name: 3-methyl-4-[2-(trifluoromethylsulfanyl)phenoxy]azepane Openeye Name: 3-methyl-4-[2-(trifluoromethylsulfanyl)phenoxy]azepane CAS Name: 3-methyl-4-[2-(trifluoromethylthio)phenoxy]azepane IUPAC Name: 3-methyl-4-[2-(trifluoromethylsulfanyl)phenoxy]azepane Traditional Name: 3-methyl-4-[2-(trifluoromethylthio)phenoxy]azepane Formula: C14H18F3NOS MolecularWeight: 305.35903

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCCC1OC2=CC=CC=C2SC(F)(F)F

Isomeric SMILES

CC1CNCCCC1OC2=CC=CC=C2SC(F)(F)F

InChI

InChI=1S/C14H18F3NOS/c1-10-9-18-8-4-6-11(10)19-12-5-2-3-7-13(12)20-14(15,16)17/h2-3,5,7,10-11,18H,4,6,8-9H2,1H3