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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C3=[N+](CCCS3)CC2(C4=CC=C(C=C4)C)O.[Br-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C3=[N+](CCCS3)CC2(C4=CC=C(C=C4)C)O.[Br-]

InChI

InChI=1S/C23H29N2OS.BrH/c1-3-4-6-19-9-13-21(14-10-19)25-22-24(15-5-16-27-22)17-23(25,26)20-11-7-18(2)8-12-20;/h7-14,26H,3-6,15-17H2,1-2H3;1H/q+1;/p-1