[(Z)-3-carbamimidoylsulfanylprop-2-enyl] carbamimidothioate bromide

Systemtic Name: [(Z)-3-carbamimidoylsulfanylprop-2-enyl] carbamimidothioate bromide Openeye Name: 2-[(Z)-3-carbamimidoylsulfanylallyl]isothiourea bromide CAS Name: carbamimidothioic acid [(Z)-3-(carbamimidoylthio)prop-2-enyl] ester bromide IUPAC Name: [(Z)-3-carbamimidoylsulfanylprop-2-enyl] carbamimidothioate bromide Traditional Name: 2-[(Z)-3-(amidinothio)allyl]isothiourea bromide Formula: C5H10BrN4S2- MolecularWeight: 270.1937

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C(/C=C\SC(=N)N)SC(=N)N.[Br-]

InChI

InChI=1S/C5H10N4S2.BrH/c6-4(7)10-2-1-3-11-5(8)9;/h1-2H,3H2,(H3,6,7)(H3,8,9);1H/p-1/b2-1-;