(Z)-2-cyano-1-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-2-(4-methylpyridin-1-ium-1-yl)ethenethiolate

Systemtic Name: (Z)-2-cyano-1-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-2-(4-methylpyridin-1-ium-1-yl)ethenethiolate Openeye Name: (Z)-2-cyano-1-(2-ethoxy-2-oxo-ethyl)sulfanyl-2-(4-methylpyridin-1-ium-1-yl)ethenethiolate CAS Name: (Z)-2-cyano-1-[(2-ethoxy-2-oxoethyl)thio]-2-(4-methyl-1-pyridin-1-iumyl)ethenethiolate IUPAC Name: (Z)-2-cyano-1-(2-ethoxy-2-oxoethyl)sulfanyl-2-(4-methylpyridin-1-ium-1-yl)ethenethiolate Traditional Name: (Z)-2-cyano-1-[(2-ethoxy-2-keto-ethyl)thio]-2-(4-methylpyridin-1-ium-1-yl)ethenethiolate Formula: C13H14N2O2S2 MolecularWeight: 294.39246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=C(C#N)[N+]1=CC=C(C=C1)C)[S-]

Isomeric SMILES

CCOC(=O)CS/C(=C(/C#N)\[N+]1=CC=C(C=C1)C)/[S-]

InChI

InChI=1S/C13H14N2O2S2/c1-3-17-12(16)9-19-13(18)11(8-14)15-6-4-10(2)5-7-15/h4-7H,3,9H2,1-2H3/b13-11-