2-(N'-methylcarbamimidoyl)sulfanylethyl N'-methylcarbamimidothioate bromide

Systemtic Name: 2-(N'-methylcarbamimidoyl)sulfanylethyl N'-methylcarbamimidothioate bromide Openeye Name: 3-methyl-2-[2-(N'-methylcarbamimidoyl)sulfanylethyl]isothiourea bromide CAS Name: N'-methylcarbamimidothioic acid 2-[[amino(methylimino)methyl]thio]ethyl ester bromide IUPAC Name: 2-(N'-methylcarbamimidoyl)sulfanylethyl N'-methylcarbamimidothioate bromide Traditional Name: 3-methyl-2-[2-[(N'-methylamidino)thio]ethyl]isothiourea bromide Formula: C6H14BrN4S2- MolecularWeight: 286.23616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)SCCSC(=NC)N.[Br-]

Isomeric SMILES

CN=C(N)SCCSC(=NC)N.[Br-]

InChI

InChI=1S/C6H14N4S2.BrH/c1-9-5(7)11-3-4-12-6(8)10-2;/h3-4H2,1-2H3,(H2,7,9)(H2,8,10);1H/p-1