3-(N'-methylcarbamimidoyl)sulfanylpropyl N'-methylcarbamimidothioate bromide

Systemtic Name: 3-(N'-methylcarbamimidoyl)sulfanylpropyl N'-methylcarbamimidothioate bromide Openeye Name: 3-methyl-2-[3-(N'-methylcarbamimidoyl)sulfanylpropyl]isothiourea bromide CAS Name: N'-methylcarbamimidothioic acid 3-[[amino(methylimino)methyl]thio]propyl ester bromide IUPAC Name: 3-(N'-methylcarbamimidoyl)sulfanylpropyl N'-methylcarbamimidothioate bromide Traditional Name: 3-methyl-2-[3-[(N'-methylamidino)thio]propyl]isothiourea bromide Formula: C7H16BrN4S2- MolecularWeight: 300.26274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H16N4S2.BrH/c1-10-6(8)12-4-3-5-13-7(9)11-2;/h3-5H2,1-2H3,(H2,8,10)(H2,9,11);1H/p-1