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

Systemtic Name: 3-fluoranyl-4-[(4-methylphenyl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-(p-tolylsulfanylmethyl)benzonitrile CAS Name: 3-fluoro-4-[[(4-methylphenyl)thio]methyl]benzonitrile IUPAC Name: 3-fluoro-4-[(4-methylphenyl)sulfanylmethyl]benzonitrile Traditional Name: 3-fluoro-4-[(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=C(C=C2)C#N)F

Isomeric SMILES

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

InChI

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