4-[(3-bromanylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]morpholin-4-ium bromide

Systemtic Name: 4-[(3-bromanylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]morpholin-4-ium bromide Openeye Name: 4-[(3-bromoimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]morpholin-4-ium bromide CAS Name: 4-[(3-bromo-2-imidazo[1,2-a]pyridinyl)methylthio]morpholin-4-ium bromide IUPAC Name: 4-[(3-bromoimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]morpholin-4-ium bromide Traditional Name: 4-[(3-bromoimidazo[1,2-a]pyridin-2-yl)methylthio]morpholin-4-ium bromide Formula: C12H15Br2N3OS MolecularWeight: 409.14

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1SCC2=C(N3C=CC=CC3=N2)Br.[Br-]

Isomeric SMILES

C1COCC[NH+]1SCC2=C(N3C=CC=CC3=N2)Br.[Br-]

InChI

InChI=1S/C12H14BrN3OS.BrH/c13-12-10(9-18-15-5-7-17-8-6-15)14-11-3-1-2-4-16(11)12;/h1-4H,5-9H2;1H