4-[(4-cyanophenyl)methylsulfanylmethyl]-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[(4-cyanophenyl)methylsulfanylmethyl]-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-[(4-cyanophenyl)methylsulfanylmethyl]-3-fluoro-benzonitrile CAS Name: 4-[[(4-cyanophenyl)methylthio]methyl]-3-fluorobenzonitrile IUPAC Name: 4-[(4-cyanophenyl)methylsulfanylmethyl]-3-fluorobenzonitrile Traditional Name: 4-[[(4-cyanobenzyl)thio]methyl]-3-fluoro-benzonitrile Formula: C16H11FN2S MolecularWeight: 282.335343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCC2=C(C=C(C=C2)C#N)F)C#N

Isomeric SMILES

C1=CC(=CC=C1CSCC2=C(C=C(C=C2)C#N)F)C#N

InChI

InChI=1S/C16H11FN2S/c17-16-7-14(9-19)5-6-15(16)11-20-10-13-3-1-12(8-18)2-4-13/h1-7H,10-11H2