1,3-dimethyl-4-[3-(trifluoromethylsulfanyl)phenoxy]azepane

Systemtic Name: 1,3-dimethyl-4-[3-(trifluoromethylsulfanyl)phenoxy]azepane Openeye Name: 1,3-dimethyl-4-[3-(trifluoromethylsulfanyl)phenoxy]azepane CAS Name: 1,3-dimethyl-4-[3-(trifluoromethylthio)phenoxy]azepane IUPAC Name: 1,3-dimethyl-4-[3-(trifluoromethylsulfanyl)phenoxy]azepane Traditional Name: 1,3-dimethyl-4-[3-(trifluoromethylthio)phenoxy]azepane Formula: C15H20F3NOS MolecularWeight: 319.38561

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCCC1OC2=CC(=CC=C2)SC(F)(F)F)C

Isomeric SMILES

CC1CN(CCCC1OC2=CC(=CC=C2)SC(F)(F)F)C

InChI

InChI=1S/C15H20F3NOS/c1-11-10-19(2)8-4-7-14(11)20-12-5-3-6-13(9-12)21-15(16,17)18/h3,5-6,9,11,14H,4,7-8,10H2,1-2H3