2-(8-oxidanylquinolin-1-ium-1-yl)ethyl carbamimidothioate bromide hydrobromide

Systemtic Name: 2-(8-oxidanylquinolin-1-ium-1-yl)ethyl carbamimidothioate bromide hydrobromide Openeye Name: 2-[2-(8-hydroxyquinolin-1-ium-1-yl)ethyl]isothiourea bromide hydrobromide CAS Name: carbamimidothioic acid 2-(8-hydroxy-1-quinolin-1-iumyl)ethyl ester bromide hydrobromide IUPAC Name: 2-(8-hydroxyquinolin-1-ium-1-yl)ethyl carbamimidothioate bromide hydrobromide Traditional Name: 2-[2-(8-hydroxyquinolin-1-ium-1-yl)ethyl]isothiourea bromide hydrobromide Formula: C12H15Br2N3OS MolecularWeight: 409.14

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)O)[N+](=CC=C2)CCSC(=N)N.Br.[Br-]

Isomeric SMILES

C1=CC2=C(C(=C1)O)[N+](=CC=C2)CCSC(=N)N.Br.[Br-]

InChI

InChI=1S/C12H13N3OS.2BrH/c13-12(14)17-8-7-15-6-2-4-9-3-1-5-10(16)11(9)15;;/h1-6H,7-8H2,(H3-,13,14,16);2*1H