2-[4-[3-(4-methoxyoxan-4-yl)-5-(trifluoromethyl)phenyl]sulfanylphenyl]-2-methyl-propanenitrile

Systemtic Name: 2-[4-[3-(4-methoxyoxan-4-yl)-5-(trifluoromethyl)phenyl]sulfanylphenyl]-2-methyl-propanenitrile Openeye Name: 2-[4-[3-(4-methoxytetrahydropyran-4-yl)-5-(trifluoromethyl)phenyl]sulfanylphenyl]-2-methyl-propanenitrile CAS Name: 2-[4-[[3-(4-methoxy-4-oxanyl)-5-(trifluoromethyl)phenyl]thio]phenyl]-2-methylpropanenitrile IUPAC Name: 2-[4-[3-(4-methoxyoxan-4-yl)-5-(trifluoromethyl)phenyl]sulfanylphenyl]-2-methylpropanenitrile Traditional Name: 2-[4-[[3-(4-methoxytetrahydropyran-4-yl)-5-(trifluoromethyl)phenyl]thio]phenyl]-2-methyl-propionitrile Formula: C23H24F3NO2S MolecularWeight: 435.50237

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC=C(C=C1)SC2=CC(=CC(=C2)C(F)(F)F)C3(CCOCC3)OC

Isomeric SMILES

CC(C)(C#N)C1=CC=C(C=C1)SC2=CC(=CC(=C2)C(F)(F)F)C3(CCOCC3)OC

InChI

InChI=1S/C23H24F3NO2S/c1-21(2,15-27)16-4-6-19(7-5-16)30-20-13-17(12-18(14-20)23(24,25)26)22(28-3)8-10-29-11-9-22/h4-7,12-14H,8-11H2,1-3H3