3-[(3-azanylpyridin-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[(3-azanylpyridin-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[(3-amino-2-pyridyl)sulfanylmethyl]benzonitrile CAS Name: 3-[[(3-amino-2-pyridinyl)thio]methyl]benzonitrile IUPAC Name: 3-[(3-aminopyridin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 3-[[(3-amino-2-pyridyl)thio]methyl]benzonitrile Formula: C13H11N3S MolecularWeight: 241.31154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=C(C=CC=N2)N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=C(C=CC=N2)N)C#N

InChI

InChI=1S/C13H11N3S/c14-8-10-3-1-4-11(7-10)9-17-13-12(15)5-2-6-16-13/h1-7H,9,15H2