3-(pyridin-2-ylsulfanylmethyl)benzenecarbonitrile

Systemtic Name: 3-(pyridin-2-ylsulfanylmethyl)benzenecarbonitrile Openeye Name: 3-(2-pyridylsulfanylmethyl)benzonitrile CAS Name: 3-[(2-pyridinylthio)methyl]benzonitrile IUPAC Name: 3-(pyridin-2-ylsulfanylmethyl)benzonitrile Traditional Name: 3-[(2-pyridylthio)methyl]benzonitrile Formula: C13H10N2S MolecularWeight: 226.2969

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SCC2=CC=CC(=C2)C#N

Isomeric SMILES

C1=CC=NC(=C1)SCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H10N2S/c14-9-11-4-3-5-12(8-11)10-16-13-6-1-2-7-15-13/h1-8H,10H2