methyl N'-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethyl]carbamimidothioate

Systemtic Name: methyl N'-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethyl]carbamimidothioate Openeye Name: 2-methyl-3-[2-(thiazol-2-ylmethylsulfanyl)ethyl]isothiourea CAS Name: N'-[2-(2-thiazolylmethylthio)ethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethyl]carbamimidothioate Traditional Name: 2-methyl-3-[2-(thiazol-2-ylmethylthio)ethyl]isothiourea Formula: C8H13N3S3 MolecularWeight: 247.40392

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCCSCC1=NC=CS1)N

Isomeric SMILES

CSC(=NCCSCC1=NC=CS1)N

InChI

InChI=1S/C8H13N3S3/c1-12-8(9)11-2-4-13-6-7-10-3-5-14-7/h3,5H,2,4,6H2,1H3,(H2,9,11)