4-carbamimidoylsulfanylbutyl carbamimidothioate bromide

Systemtic Name: 4-carbamimidoylsulfanylbutyl carbamimidothioate bromide Openeye Name: 2-(4-carbamimidoylsulfanylbutyl)isothiourea bromide CAS Name: carbamimidothioic acid 4-(carbamimidoylthio)butyl ester bromide IUPAC Name: 4-carbamimidoylsulfanylbutyl carbamimidothioate bromide Traditional Name: 2-[4-(amidinothio)butyl]isothiourea bromide Formula: C6H14BrN4S2- MolecularWeight: 286.23616

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Descriptors Computed from Structure

Canonical SMILES:

C(CCSC(=N)N)CSC(=N)N.[Br-]

Isomeric SMILES

C(CCSC(=N)N)CSC(=N)N.[Br-]

InChI

InChI=1S/C6H14N4S2.BrH/c7-5(8)11-3-1-2-4-12-6(9)10;/h1-4H2,(H3,7,8)(H3,9,10);1H/p-1