methyl N'-(6-chloranylpyridin-3-yl)-N-cyano-carbamimidothioate

Systemtic Name: methyl N'-(6-chloranylpyridin-3-yl)-N-cyano-carbamimidothioate Openeye Name: 3-(6-chloro-3-pyridyl)-1-cyano-2-methyl-isothiourea CAS Name: N'-(6-chloro-3-pyridinyl)-N-cyanocarbamimidothioic acid methyl ester IUPAC Name: methyl N'-(6-chloropyridin-3-yl)-N-cyanocarbamimidothioate Traditional Name: 3-(6-chloro-3-pyridyl)-1-cyano-2-methyl-isothiourea Formula: C8H7ClN4S MolecularWeight: 226.68598

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CN=C(C=C1)Cl)NC#N

Isomeric SMILES

CSC(=NC1=CN=C(C=C1)Cl)NC#N

InChI

InChI=1S/C8H7ClN4S/c1-14-8(12-5-10)13-6-2-3-7(9)11-4-6/h2-4H,1H3,(H,12,13)