(3-cyanopyridin-2-yl) N'-methylcarbamimidothioate hydrochloride

Systemtic Name: (3-cyanopyridin-2-yl) N'-methylcarbamimidothioate hydrochloride Openeye Name: 2-(3-cyano-2-pyridyl)-3-methyl-isothiourea hydrochloride CAS Name: N'-methylcarbamimidothioic acid (3-cyano-2-pyridinyl) ester hydrochloride IUPAC Name: (3-cyanopyridin-2-yl) N'-methylcarbamimidothioate hydrochloride Traditional Name: 2-(3-cyano-2-pyridyl)-3-methyl-isothiourea hydrochloride Formula: C8H9ClN4S MolecularWeight: 228.70186

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)SC1=C(C=CC=N1)C#N.Cl

Isomeric SMILES

CN=C(N)SC1=C(C=CC=N1)C#N.Cl

InChI

InChI=1S/C8H8N4S.ClH/c1-11-8(10)13-7-6(5-9)3-2-4-12-7;/h2-4H,1H3,(H2,10,11);1H