(5-bromanyl-1-oxidanidyl-pyridin-1-ium-3-yl) carbamimidothioate hydrobromide

Systemtic Name: (5-bromanyl-1-oxidanidyl-pyridin-1-ium-3-yl) carbamimidothioate hydrobromide Openeye Name: 2-(5-bromo-1-oxido-pyridin-1-ium-3-yl)isothiourea hydrobromide CAS Name: carbamimidothioic acid (5-bromo-1-oxido-3-pyridin-1-iumyl) ester hydrobromide IUPAC Name: (5-bromo-1-oxidopyridin-1-ium-3-yl) carbamimidothioate hydrobromide Traditional Name: 2-(5-bromo-1-oxido-pyridin-1-ium-3-yl)isothiourea hydrobromide Formula: C6H7Br2N3OS MolecularWeight: 329.01228

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=[N+](C=C1Br)[O-])SC(=N)N.Br

Isomeric SMILES

C1=C(C=[N+](C=C1Br)[O-])SC(=N)N.Br

InChI

InChI=1S/C6H6BrN3OS.BrH/c7-4-1-5(12-6(8)9)3-10(11)2-4;/h1-3H,(H3,8,9);1H