methyl N-(6-chloranylpyridin-3-yl)-N,N'-diethyl-carbamimidothioate

Systemtic Name: methyl N-(6-chloranylpyridin-3-yl)-N,N'-diethyl-carbamimidothioate Openeye Name: 1-(6-chloro-3-pyridyl)-1,3-diethyl-2-methyl-isothiourea CAS Name: N-(6-chloro-3-pyridinyl)-N,N'-diethylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-(6-chloropyridin-3-yl)-N,N'-diethylcarbamimidothioate Traditional Name: 1-(6-chloro-3-pyridyl)-1,3-diethyl-2-methyl-isothiourea Formula: C11H16ClN3S MolecularWeight: 257.78284

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(N(CC)C1=CN=C(C=C1)Cl)SC

Isomeric SMILES

CCN=C(N(CC)C1=CN=C(C=C1)Cl)SC

InChI

InChI=1S/C11H16ClN3S/c1-4-13-11(16-3)15(5-2)9-6-7-10(12)14-8-9/h6-8H,4-5H2,1-3H3