2-[2-carbamimidoylsulfanylethyl(methyl)amino]ethyl carbamimidothioate trihydrobromide

Systemtic Name: 2-[2-carbamimidoylsulfanylethyl(methyl)amino]ethyl carbamimidothioate trihydrobromide Openeye Name: 2-[2-[2-carbamimidoylsulfanylethyl(methyl)amino]ethyl]isothiourea trihydrobromide CAS Name: carbamimidothioic acid 2-[2-(carbamimidoylthio)ethyl-methylamino]ethyl ester trihydrobromide IUPAC Name: 2-[2-carbamimidoylsulfanylethyl(methyl)amino]ethyl carbamimidothioate trihydrobromide Traditional Name: 2-[2-[2-(amidinothio)ethyl-methyl-amino]ethyl]isothiourea trihydrobromide Formula: C7H20Br3N5S2 MolecularWeight: 478.1092

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCSC(=N)N)CCSC(=N)N.Br.Br.Br

Isomeric SMILES

CN(CCSC(=N)N)CCSC(=N)N.Br.Br.Br

InChI

InChI=1S/C7H17N5S2.3BrH/c1-12(2-4-13-6(8)9)3-5-14-7(10)11;;;/h2-5H2,1H3,(H3,8,9)(H3,10,11);3*1H