2-[(3-cyanophenyl)methylsulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[(3-cyanophenyl)methylsulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[(3-cyanophenyl)methylsulfanylmethyl]benzonitrile CAS Name: 2-[[(3-cyanophenyl)methylthio]methyl]benzonitrile IUPAC Name: 2-[(3-cyanophenyl)methylsulfanylmethyl]benzonitrile Traditional Name: 2-[[(3-cyanobenzyl)thio]methyl]benzonitrile Formula: C16H12N2S MolecularWeight: 264.34488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCC2=CC=CC(=C2)C#N)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCC2=CC=CC(=C2)C#N)C#N

InChI

InChI=1S/C16H12N2S/c17-9-13-4-3-5-14(8-13)11-19-12-16-7-2-1-6-15(16)10-18/h1-8H,11-12H2