2-[4-[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenyl]sulfanylphenyl]ethanenitrile

Systemtic Name: 2-[4-[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenyl]sulfanylphenyl]ethanenitrile Openeye Name: 2-[4-[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenyl]sulfanylphenyl]acetonitrile CAS Name: 2-[4-[[3-fluoro-5-(4-methoxy-4-oxanyl)phenyl]thio]phenyl]acetonitrile IUPAC Name: 2-[4-[3-fluoro-5-(4-methoxyoxan-4-yl)phenyl]sulfanylphenyl]acetonitrile Traditional Name: 2-[4-[[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenyl]thio]phenyl]acetonitrile Formula: C20H20FNO2S MolecularWeight: 357.441703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1(CCOCC1)C2=CC(=CC(=C2)SC3=CC=C(C=C3)CC#N)F

Isomeric SMILES

COC1(CCOCC1)C2=CC(=CC(=C2)SC3=CC=C(C=C3)CC#N)F

InChI

InChI=1S/C20H20FNO2S/c1-23-20(7-10-24-11-8-20)16-12-17(21)14-19(13-16)25-18-4-2-15(3-5-18)6-9-22/h2-5,12-14H,6-8,10-11H2,1H3