4,6-dimethyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-[2-(1-piperidin-1-iumyl)ethylthio]-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)pyridine-3-carbonitrile Traditional Name: 4,6-dimethyl-2-(2-piperidin-1-ium-1-ylethylthio)nicotinonitrile Formula: C15H22N3S+ MolecularWeight: 276.42028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC[NH+]2CCCCC2)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC[NH+]2CCCCC2)C

InChI

InChI=1S/C15H21N3S/c1-12-10-13(2)17-15(14(12)11-16)19-9-8-18-6-4-3-5-7-18/h10H,3-9H2,1-2H3/p+1