methyl N-[2-[(3-methoxypyridin-2-yl)methylsulfanyl]ethyl]-N'-methyl-carbamimidothioate

Systemtic Name: methyl N-[2-[(3-methoxypyridin-2-yl)methylsulfanyl]ethyl]-N'-methyl-carbamimidothioate Openeye Name: 1-[2-[(3-methoxy-2-pyridyl)methylsulfanyl]ethyl]-2,3-dimethyl-isothiourea CAS Name: N-[2-[(3-methoxy-2-pyridinyl)methylthio]ethyl]-N'-methylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-[2-[(3-methoxypyridin-2-yl)methylsulfanyl]ethyl]-N'-methylcarbamimidothioate Traditional Name: 1-[2-[(3-methoxy-2-pyridyl)methylthio]ethyl]-2,3-dimethyl-isothiourea Formula: C12H19N3OS2 MolecularWeight: 285.42876

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NCCSCC1=C(C=CC=N1)OC)SC

Isomeric SMILES

CN=C(NCCSCC1=C(C=CC=N1)OC)SC

InChI

InChI=1S/C12H19N3OS2/c1-13-12(17-3)15-7-8-18-9-10-11(16-2)5-4-6-14-10/h4-6H,7-9H2,1-3H3,(H,13,15)