methyl N-cyano-N'-[2-(pyridin-2-ylmethylsulfanyl)ethyl]carbamimidothioate

Systemtic Name: methyl N-cyano-N'-[2-(pyridin-2-ylmethylsulfanyl)ethyl]carbamimidothioate Openeye Name: 1-cyano-2-methyl-3-[2-(2-pyridylmethylsulfanyl)ethyl]isothiourea CAS Name: N-cyano-N'-[2-(2-pyridinylmethylthio)ethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N-cyano-N'-[2-(pyridin-2-ylmethylsulfanyl)ethyl]carbamimidothioate Traditional Name: 1-cyano-2-methyl-3-[2-(2-pyridylmethylthio)ethyl]isothiourea Formula: C11H14N4S2 MolecularWeight: 266.38566

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCCSCC1=CC=CC=N1)NC#N

Isomeric SMILES

CSC(=NCCSCC1=CC=CC=N1)NC#N

InChI

InChI=1S/C11H14N4S2/c1-16-11(15-9-12)14-6-7-17-8-10-4-2-3-5-13-10/h2-5H,6-8H2,1H3,(H,14,15)