methyl N'-[2-(pyridin-3-ylmethylsulfanyl)ethyl]carbamimidothioate

Systemtic Name: methyl N'-[2-(pyridin-3-ylmethylsulfanyl)ethyl]carbamimidothioate Openeye Name: 2-methyl-3-[2-(3-pyridylmethylsulfanyl)ethyl]isothiourea CAS Name: N'-[2-(3-pyridinylmethylthio)ethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[2-(pyridin-3-ylmethylsulfanyl)ethyl]carbamimidothioate Traditional Name: 2-methyl-3-[2-(3-pyridylmethylthio)ethyl]isothiourea Formula: C10H15N3S2 MolecularWeight: 241.3762

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCCSCC1=CN=CC=C1)N

Isomeric SMILES

CSC(=NCCSCC1=CN=CC=C1)N

InChI

InChI=1S/C10H15N3S2/c1-14-10(11)13-5-6-15-8-9-3-2-4-12-7-9/h2-4,7H,5-6,8H2,1H3,(H2,11,13)