(E)-2-cyano-1-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)ethenethiolate

Systemtic Name: (E)-2-cyano-1-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)ethenethiolate Openeye Name: (E)-2-cyano-1-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)ethenethiolate CAS Name: (E)-2-cyano-1-(ethylthio)-2-(4-methyl-1-pyridin-1-iumyl)ethenethiolate IUPAC Name: (E)-2-cyano-1-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)ethenethiolate Traditional Name: (E)-2-cyano-1-(ethylthio)-2-(4-methylpyridin-1-ium-1-yl)ethenethiolate Formula: C11H12N2S2 MolecularWeight: 236.35638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=C(C#N)[N+]1=CC=C(C=C1)C)[S-]

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2S2/c1-3-15-11(14)10(8-12)13-6-4-9(2)5-7-13/h4-7H,3H2,1-2H3/b11-10+