(1E)-N-(4-methylpyridin-1-ium-1-yl)-2-thiocyanato-ethanimidate

Systemtic Name: (1E)-N-(4-methylpyridin-1-ium-1-yl)-2-thiocyanato-ethanimidate Openeye Name: (1E)-N-(4-methylpyridin-1-ium-1-yl)-2-thiocyanato-ethanimidate CAS Name: (1E)-N-(4-methyl-1-pyridin-1-iumyl)-2-thiocyanatoethanimidate IUPAC Name: (1E)-N-(4-methylpyridin-1-ium-1-yl)-2-thiocyanatoethanimidate Traditional Name: (1E)-N-(4-methylpyridin-1-ium-1-yl)-2-thiocyanato-acetimidate Formula: C9H9N3OS MolecularWeight: 207.25226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)N=C(CSC#N)[O-]

Isomeric SMILES

CC1=CC=[N+](C=C1)/N=C(\CSC#N)/[O-]

InChI

InChI=1S/C9H9N3OS/c1-8-2-4-12(5-3-8)11-9(13)6-14-7-10/h2-5H,6H2,1H3