2-(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)sulfanylethanamide

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)sulfanylethanamide Openeye Name: 2-(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)sulfanylacetamide CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: 2-(3-cyano-4,6-dimethylpyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: 2-[(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)thio]acetamide Formula: C10H12N3OS+ MolecularWeight: 222.28678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1C#N)SCC(=O)N)C

Isomeric SMILES

CC1=CC(=[NH+]C(=C1C#N)SCC(=O)N)C

InChI

InChI=1S/C10H11N3OS/c1-6-3-7(2)13-10(8(6)4-11)15-5-9(12)14/h3H,5H2,1-2H3,(H2,12,14)/p+1