4-[3-(4-fluorophenyl)sulfanylphenyl]oxane-4-carbonitrile

Systemtic Name: 4-[3-(4-fluorophenyl)sulfanylphenyl]oxane-4-carbonitrile Openeye Name: 4-[3-(4-fluorophenyl)sulfanylphenyl]tetrahydropyran-4-carbonitrile CAS Name: 4-[3-[(4-fluorophenyl)thio]phenyl]-4-oxanecarbonitrile IUPAC Name: 4-[3-(4-fluorophenyl)sulfanylphenyl]oxane-4-carbonitrile Traditional Name: 4-[3-[(4-fluorophenyl)thio]phenyl]tetrahydropyran-4-carbonitrile Formula: C18H16FNOS MolecularWeight: 313.389143

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C#N)C2=CC(=CC=C2)SC3=CC=C(C=C3)F

Isomeric SMILES

C1COCCC1(C#N)C2=CC(=CC=C2)SC3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FNOS/c19-15-4-6-16(7-5-15)22-17-3-1-2-14(12-17)18(13-20)8-10-21-11-9-18/h1-7,12H,8-11H2