ethyl (Z)-2-(4-methylpyridin-1-ium-1-yl)-3-methylsulfanyl-3-sulfanyl-prop-2-enoate

Systemtic Name: ethyl (Z)-2-(4-methylpyridin-1-ium-1-yl)-3-methylsulfanyl-3-sulfanyl-prop-2-enoate Openeye Name: ethyl (Z)-2-(4-methylpyridin-1-ium-1-yl)-3-methylsulfanyl-3-sulfanyl-prop-2-enoate CAS Name: (Z)-3-mercapto-2-(4-methyl-1-pyridin-1-iumyl)-3-(methylthio)-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-(4-methylpyridin-1-ium-1-yl)-3-methylsulfanyl-3-sulfanylprop-2-enoate Traditional Name: (Z)-3-mercapto-2-(4-methylpyridin-1-ium-1-yl)-3-(methylthio)acrylic acid ethyl ester Formula: C12H16NO2S2+ MolecularWeight: 270.39094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(S)SC)[N+]1=CC=C(C=C1)C

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO2S2/c1-4-15-11(14)10(12(16)17-3)13-7-5-9(2)6-8-13/h5-8H,4H2,1-3H3/p+1