4-(pyridin-4-ylmethylsulfanyl)pyridine-2-carbonitrile

Systemtic Name: 4-(pyridin-4-ylmethylsulfanyl)pyridine-2-carbonitrile Openeye Name: 4-(4-pyridylmethylsulfanyl)pyridine-2-carbonitrile CAS Name: 4-(pyridin-4-ylmethylthio)-2-pyridinecarbonitrile IUPAC Name: 4-(pyridin-4-ylmethylsulfanyl)pyridine-2-carbonitrile Traditional Name: 4-(4-pyridylmethylthio)picolinonitrile Formula: C12H9N3S MolecularWeight: 227.28496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CSC2=CC(=NC=C2)C#N

Isomeric SMILES

C1=CN=CC=C1CSC2=CC(=NC=C2)C#N

InChI

InChI=1S/C12H9N3S/c13-8-11-7-12(3-6-15-11)16-9-10-1-4-14-5-2-10/h1-7H,9H2