3-(4-tert-butylphenyl)-1-(2-methylphenyl)-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide

Systemtic Name: 3-(4-tert-butylphenyl)-1-(2-methylphenyl)-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide Openeye Name: 3-(4-tert-butylphenyl)-1-(o-tolyl)-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide CAS Name: 3-(4-tert-butylphenyl)-1-(2-methylphenyl)-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide IUPAC Name: 3-(4-tert-butylphenyl)-1-(2-methylphenyl)-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide Traditional Name: 3-(4-tert-butylphenyl)-1-(o-tolyl)-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide Formula: C23H29BrN2OS MolecularWeight: 461.45816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC([N+]3=C2SCCC3)(C4=CC=C(C=C4)C(C)(C)C)O.[Br-]

Isomeric SMILES

CC1=CC=CC=C1N2CC([N+]3=C2SCCC3)(C4=CC=C(C=C4)C(C)(C)C)O.[Br-]

InChI

InChI=1S/C23H29N2OS.BrH/c1-17-8-5-6-9-20(17)24-16-23(26,25-14-7-15-27-21(24)25)19-12-10-18(11-13-19)22(2,3)4;/h5-6,8-13,26H,7,14-16H2,1-4H3;1H/q+1;/p-1