4-carbamimidoylsulfanylpentyl carbamimidothioate bromide

Systemtic Name: 4-carbamimidoylsulfanylpentyl carbamimidothioate bromide Openeye Name: 2-(4-carbamimidoylsulfanyl-1-methyl-butyl)isothiourea bromide CAS Name: carbamimidothioic acid 4-(carbamimidoylthio)pentyl ester bromide IUPAC Name: 4-carbamimidoylsulfanylpentyl carbamimidothioate bromide Traditional Name: 2-[4-(amidinothio)-1-methyl-butyl]isothiourea bromide Formula: C7H16BrN4S2- MolecularWeight: 300.26274

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCSC(=N)N)SC(=N)N.[Br-]

Isomeric SMILES

CC(CCCSC(=N)N)SC(=N)N.[Br-]

InChI

InChI=1S/C7H16N4S2.BrH/c1-5(13-7(10)11)3-2-4-12-6(8)9;/h5H,2-4H2,1H3,(H3,8,9)(H3,10,11);1H/p-1