(E)-5-ethoxy-1-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-5-oxidanylidene-1-sulfanylidene-pent-2-en-3-olate

Systemtic Name: (E)-5-ethoxy-1-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-5-oxidanylidene-1-sulfanylidene-pent-2-en-3-olate Openeye Name: (E)-5-ethoxy-1-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-5-oxo-1-thioxo-pent-2-en-3-olate CAS Name: (E)-5-ethoxy-1-(ethylthio)-2-(4-methyl-1-pyridin-1-iumyl)-5-oxo-1-sulfanylidene-2-penten-3-olate IUPAC Name: (E)-5-ethoxy-1-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-5-oxo-1-sulfanylidenepent-2-en-3-olate Traditional Name: (E)-5-ethoxy-1-(ethylthio)-5-keto-2-(4-methylpyridin-1-ium-1-yl)-1-thioxo-pent-2-en-3-olate Formula: C15H19NO3S2 MolecularWeight: 325.44626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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