methyl N-[bis(azanyl)methylidene]-N'-ethyl-carbamimidothioate hydroiodide

Systemtic Name: methyl N-[bis(azanyl)methylidene]-N'-ethyl-carbamimidothioate hydroiodide Openeye Name: 1-(diaminomethylene)-3-ethyl-2-methyl-isothiourea hydroiodide CAS Name: N-(diaminomethylidene)-N'-ethylcarbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N-(diaminomethylidene)-N'-ethylcarbamimidothioate hydroiodide Traditional Name: 1-(diaminomethylene)-3-ethyl-2-methyl-isothiourea hydroiodide Formula: C5H13IN4S MolecularWeight: 288.15299

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN=C(N=C(N)N)SC.I

Isomeric SMILES

CCN=C(N=C(N)N)SC.I

InChI

InChI=1S/C5H12N4S.HI/c1-3-8-5(10-2)9-4(6)7;/h3H2,1-2H3,(H4,6,7,8,9);1H