4,6-dimethyl-2-pyridin-2-ylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-pyridin-2-ylsulfanyl-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-(2-pyridylsulfanyl)pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-(2-pyridinylthio)-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-2-pyridin-2-ylsulfanylpyridine-3-carbonitrile Traditional Name: 4,6-dimethyl-2-(2-pyridylthio)nicotinonitrile Formula: C13H11N3S MolecularWeight: 241.31154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SC2=CC=CC=N2)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC2=CC=CC=N2)C

InChI

InChI=1S/C13H11N3S/c1-9-7-10(2)16-13(11(9)8-14)17-12-5-3-4-6-15-12/h3-7H,1-2H3