3-chloranyl-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyridin-4-ium bromide

Systemtic Name: 3-chloranyl-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyridin-4-ium bromide Openeye Name: 3-chloro-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyridin-4-ium bromide CAS Name: 3-chloro-2-[[(4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1H-imidazo[1,2-a]pyridin-4-ium bromide IUPAC Name: 3-chloro-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyridin-4-ium bromide Traditional Name: 3-chloro-2-[[(4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1H-imidazo[1,2-a]pyridin-4-ium bromide Formula: C16H13BrClN5S MolecularWeight: 422.72992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NN=C2SCC3=C([N+]4=CC=CC=C4N3)Cl.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=NN=C2SCC3=C([N+]4=CC=CC=C4N3)Cl.[Br-]

InChI

InChI=1S/C16H12ClN5S.BrH/c17-15-13(19-14-8-4-5-9-21(14)15)10-23-16-20-18-11-22(16)12-6-2-1-3-7-12;/h1-9,11H,10H2;1H