(Z,3Z)-2-cyano-1-methoxy-3-(3-methylbenzimidazol-3-ium-1-yl)imino-3-methylsulfanyl-prop-1-en-1-olate

Systemtic Name: (Z,3Z)-2-cyano-1-methoxy-3-(3-methylbenzimidazol-3-ium-1-yl)imino-3-methylsulfanyl-prop-1-en-1-olate Openeye Name: (Z,3Z)-2-cyano-1-methoxy-3-(3-methylbenzimidazol-3-ium-1-yl)imino-3-methylsulfanyl-prop-1-en-1-olate CAS Name: (Z,3Z)-2-cyano-1-methoxy-3-[(3-methyl-1-benzimidazol-3-iumyl)imino]-3-(methylthio)-1-propen-1-olate IUPAC Name: (Z,3Z)-2-cyano-1-methoxy-3-(3-methylbenzimidazol-3-ium-1-yl)imino-3-methylsulfanylprop-1-en-1-olate Traditional Name: (Z,3Z)-2-cyano-1-methoxy-3-(3-methylbenzimidazol-3-ium-1-yl)imino-3-(methylthio)prop-1-en-1-olate Formula: C14H14N4O2S MolecularWeight: 302.35156

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C2=CC=CC=C21)N=C(C(=C([O-])OC)C#N)SC

Isomeric SMILES

C[N+]1=CN(C2=CC=CC=C21)/N=C(/C(=C(/[O-])\OC)/C#N)\SC

InChI

InChI=1S/C14H14N4O2S/c1-17-9-18(12-7-5-4-6-11(12)17)16-13(21-3)10(8-15)14(19)20-2/h4-7,9H,1-3H3