3-tert-butyl-1-phenyl-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide

Systemtic Name: 3-tert-butyl-1-phenyl-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide Openeye Name: 3-tert-butyl-1-phenyl-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide CAS Name: 3-tert-butyl-1-phenyl-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide IUPAC Name: 3-tert-butyl-1-phenyl-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide Traditional Name: 3-tert-butyl-1-phenyl-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide Formula: C16H23BrN2OS MolecularWeight: 371.33562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CN(C2=[N+]1CCCS2)C3=CC=CC=C3)O.[Br-]

Isomeric SMILES

CC(C)(C)C1(CN(C2=[N+]1CCCS2)C3=CC=CC=C3)O.[Br-]

InChI

InChI=1S/C16H23N2OS.BrH/c1-15(2,3)16(19)12-17(13-8-5-4-6-9-13)14-18(16)10-7-11-20-14;/h4-6,8-9,19H,7,10-12H2,1-3H3;1H/q+1;/p-1