(E)-2-(3,5-dimethylpyridin-1-ium-1-yl)-5-ethoxy-1-methylsulfanyl-5-oxidanylidene-1-sulfanylidene-pent-2-en-3-olate

Systemtic Name: (E)-2-(3,5-dimethylpyridin-1-ium-1-yl)-5-ethoxy-1-methylsulfanyl-5-oxidanylidene-1-sulfanylidene-pent-2-en-3-olate Openeye Name: (E)-2-(3,5-dimethylpyridin-1-ium-1-yl)-5-ethoxy-1-methylsulfanyl-5-oxo-1-thioxo-pent-2-en-3-olate CAS Name: (E)-2-(3,5-dimethyl-1-pyridin-1-iumyl)-5-ethoxy-1-(methylthio)-5-oxo-1-sulfanylidene-2-penten-3-olate IUPAC Name: (E)-2-(3,5-dimethylpyridin-1-ium-1-yl)-5-ethoxy-1-methylsulfanyl-5-oxo-1-sulfanylidenepent-2-en-3-olate Traditional Name: (E)-2-(3,5-dimethylpyridin-1-ium-1-yl)-5-ethoxy-5-keto-1-(methylthio)-1-thioxo-pent-2-en-3-olate Formula: C15H19NO3S2 MolecularWeight: 325.44626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO3S2/c1-5-19-13(18)7-12(17)14(15(20)21-4)16-8-10(2)6-11(3)9-16/h6,8-9H,5,7H2,1-4H3