6-(N'-prop-2-enylcarbamimidoyl)sulfanylhexyl N'-prop-2-enylcarbamimidothioate bromide

Systemtic Name: 6-(N'-prop-2-enylcarbamimidoyl)sulfanylhexyl N'-prop-2-enylcarbamimidothioate bromide Openeye Name: 3-allyl-2-[6-(N'-allylcarbamimidoyl)sulfanylhexyl]isothiourea bromide CAS Name: N'-prop-2-enylcarbamimidothioic acid 6-[[amino(prop-2-enylimino)methyl]thio]hexyl ester bromide IUPAC Name: 6-(N'-prop-2-enylcarbamimidoyl)sulfanylhexyl N'-prop-2-enylcarbamimidothioate bromide Traditional Name: 3-allyl-2-[6-[(N'-allylamidino)thio]hexyl]isothiourea bromide Formula: C14H26BrN4S2- MolecularWeight: 394.41704

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN=C(N)SCCCCCCSC(=NCC=C)N.[Br-]

Isomeric SMILES

C=CCN=C(N)SCCCCCCSC(=NCC=C)N.[Br-]

InChI

InChI=1S/C14H26N4S2.BrH/c1-3-9-17-13(15)19-11-7-5-6-8-12-20-14(16)18-10-4-2;/h3-4H,1-2,5-12H2,(H2,15,17)(H2,16,18);1H/p-1