[1-[(4-methylpyridin-1-ium-1-yl)amino]-1-oxidanylidene-propan-2-yl] thiocyanate

Systemtic Name: [1-[(4-methylpyridin-1-ium-1-yl)amino]-1-oxidanylidene-propan-2-yl] thiocyanate Openeye Name: [1-methyl-2-[(4-methylpyridin-1-ium-1-yl)amino]-2-oxo-ethyl] thiocyanate CAS Name: thiocyanic acid [1-[(4-methyl-1-pyridin-1-iumyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-methylpyridin-1-ium-1-yl)amino]-1-oxopropan-2-yl] thiocyanate Traditional Name: thiocyanic acid [2-keto-1-methyl-2-[(4-methylpyridin-1-ium-1-yl)amino]ethyl] ester Formula: C10H12N3OS+ MolecularWeight: 222.28678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)NC(=O)C(C)SC#N

Isomeric SMILES

CC1=CC=[N+](C=C1)NC(=O)C(C)SC#N

InChI

InChI=1S/C10H11N3OS/c1-8-3-5-13(6-4-8)12-10(14)9(2)15-7-11/h3-6,9H,1-2H3/p+1