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

Systemtic Name: 4-[(4-chlorophenyl)sulfanylmethyl]-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-[(4-chlorophenyl)sulfanylmethyl]-3-fluoro-benzonitrile CAS Name: 4-[[(4-chlorophenyl)thio]methyl]-3-fluorobenzonitrile IUPAC Name: 4-[(4-chlorophenyl)sulfanylmethyl]-3-fluorobenzonitrile Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]-3-fluoro-benzonitrile Formula: C14H9ClFNS MolecularWeight: 277.744363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9ClFNS/c15-12-3-5-13(6-4-12)18-9-11-2-1-10(8-17)7-14(11)16/h1-7H,9H2