4-[4-methoxy-3-naphthalen-2-ylsulfanyl-5-(trifluoromethyl)phenyl]oxane

Systemtic Name: 4-[4-methoxy-3-naphthalen-2-ylsulfanyl-5-(trifluoromethyl)phenyl]oxane Openeye Name: 4-[4-methoxy-3-(2-naphthylsulfanyl)-5-(trifluoromethyl)phenyl]tetrahydropyran CAS Name: 4-[4-methoxy-3-(2-naphthalenylthio)-5-(trifluoromethyl)phenyl]oxane IUPAC Name: 4-[4-methoxy-3-naphthalen-2-ylsulfanyl-5-(trifluoromethyl)phenyl]oxane Traditional Name: 4-[4-methoxy-3-(2-naphthylthio)-5-(trifluoromethyl)phenyl]tetrahydropyran Formula: C23H21F3O2S MolecularWeight: 418.47185

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1SC2=CC3=CC=CC=C3C=C2)C4CCOCC4)C(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1SC2=CC3=CC=CC=C3C=C2)C4CCOCC4)C(F)(F)F

InChI

InChI=1S/C23H21F3O2S/c1-27-22-20(23(24,25)26)13-18(16-8-10-28-11-9-16)14-21(22)29-19-7-6-15-4-2-3-5-17(15)12-19/h2-7,12-14,16H,8-11H2,1H3