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

Systemtic Name: 3-[(4-bromophenyl)sulfanylmethyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(4-bromophenyl)sulfanylmethyl]-4-fluoro-benzonitrile CAS Name: 3-[[(4-bromophenyl)thio]methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(4-bromophenyl)sulfanylmethyl]-4-fluorobenzonitrile Traditional Name: 3-[[(4-bromophenyl)thio]methyl]-4-fluoro-benzonitrile Formula: C14H9BrFNS MolecularWeight: 322.195363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCC2=C(C=CC(=C2)C#N)F)Br

Isomeric SMILES

C1=CC(=CC=C1SCC2=C(C=CC(=C2)C#N)F)Br

InChI

InChI=1S/C14H9BrFNS/c15-12-2-4-13(5-3-12)18-9-11-7-10(8-17)1-6-14(11)16/h1-7H,9H2