2-[pyridin-2-yl(sulfanyl)methyl]benzenecarbonitrile

Systemtic Name: 2-[pyridin-2-yl(sulfanyl)methyl]benzenecarbonitrile Openeye Name: 2-[2-pyridyl(sulfanyl)methyl]benzonitrile CAS Name: 2-[mercapto(2-pyridinyl)methyl]benzonitrile IUPAC Name: 2-[pyridin-2-yl(sulfanyl)methyl]benzonitrile Traditional Name: 2-[mercapto(2-pyridyl)methyl]benzonitrile Formula: C13H10N2S MolecularWeight: 226.2969

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)C(C2=CC=CC=N2)S

Isomeric SMILES

C1=CC=C(C(=C1)C#N)C(C2=CC=CC=N2)S

InChI

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