2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidanidyl-pyridin-1-ium bromide

Systemtic Name: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidanidyl-pyridin-1-ium bromide Openeye Name: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxido-pyridin-1-ium bromide CAS Name: 2-(4,5-dihydro-1H-imidazol-2-ylthio)-1-oxidopyridin-1-ium bromide IUPAC Name: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-oxidopyridin-1-ium bromide Traditional Name: 2-(2-imidazolin-2-ylthio)-1-oxido-pyridin-1-ium bromide Formula: C8H9BrN3OS- MolecularWeight: 275.14556

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)SC2=CC=CC=[N+]2[O-].[Br-]

Isomeric SMILES

C1CN=C(N1)SC2=CC=CC=[N+]2[O-].[Br-]

InChI

InChI=1S/C8H9N3OS.BrH/c12-11-6-2-1-3-7(11)13-8-9-4-5-10-8;/h1-3,6H,4-5H2,(H,9,10);1H/p-1