methyl N'-[2-(1H-pyrazol-5-ylmethylsulfanyl)ethyl]carbamimidothioate

Systemtic Name: methyl N'-[2-(1H-pyrazol-5-ylmethylsulfanyl)ethyl]carbamimidothioate Openeye Name: 2-methyl-3-[2-(1H-pyrazol-5-ylmethylsulfanyl)ethyl]isothiourea CAS Name: N'-[2-(1H-pyrazol-5-ylmethylthio)ethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[2-(1H-pyrazol-5-ylmethylsulfanyl)ethyl]carbamimidothioate Traditional Name: 2-methyl-3-[2-(1H-pyrazol-5-ylmethylthio)ethyl]isothiourea Formula: C8H14N4S2 MolecularWeight: 230.35356

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCCSCC1=CC=NN1)N

Isomeric SMILES

CSC(=NCCSCC1=CC=NN1)N

InChI

InChI=1S/C8H14N4S2/c1-13-8(9)10-4-5-14-6-7-2-3-11-12-7/h2-3H,4-6H2,1H3,(H2,9,10)(H,11,12)