4-fluoranyl-3-[(4-methylphenyl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-fluoranyl-3-[(4-methylphenyl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-fluoro-3-(p-tolylsulfanylmethyl)benzonitrile CAS Name: 4-fluoro-3-[[(4-methylphenyl)thio]methyl]benzonitrile IUPAC Name: 4-fluoro-3-[(4-methylphenyl)sulfanylmethyl]benzonitrile Traditional Name: 4-fluoro-3-[(p-tolylthio)methyl]benzonitrile Formula: C15H12FNS MolecularWeight: 257.325883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=C(C=CC(=C2)C#N)F

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=C(C=CC(=C2)C#N)F

InChI

InChI=1S/C15H12FNS/c1-11-2-5-14(6-3-11)18-10-13-8-12(9-17)4-7-15(13)16/h2-8H,10H2,1H3