4,6-dimethyl-2-(2-oxidanylidenecyclohexyl)sulfanyl-pyridin-1-ium-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-(2-oxidanylidenecyclohexyl)sulfanyl-pyridin-1-ium-3-carbonitrile Openeye Name: 4,6-dimethyl-2-(2-oxocyclohexyl)sulfanyl-pyridin-1-ium-3-carbonitrile CAS Name: 4,6-dimethyl-2-[(2-oxocyclohexyl)thio]-3-pyridin-1-iumcarbonitrile IUPAC Name: 4,6-dimethyl-2-(2-oxocyclohexyl)sulfanylpyridin-1-ium-3-carbonitrile Traditional Name: 2-[(2-ketocyclohexyl)thio]-4,6-dimethyl-pyridin-1-ium-3-carbonitrile Formula: C14H17N2OS+ MolecularWeight: 261.36258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1C#N)SC2CCCCC2=O)C

Isomeric SMILES

CC1=CC(=[NH+]C(=C1C#N)SC2CCCCC2=O)C

InChI

InChI=1S/C14H16N2OS/c1-9-7-10(2)16-14(11(9)8-15)18-13-6-4-3-5-12(13)17/h7,13H,3-6H2,1-2H3/p+1