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

Systemtic Name: 3-(4-ethoxyphenyl)-1-(2-methylphenyl)-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide Openeye Name: 3-(4-ethoxyphenyl)-1-(o-tolyl)-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide CAS Name: 3-(4-ethoxyphenyl)-1-(2-methylphenyl)-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide IUPAC Name: 3-(4-ethoxyphenyl)-1-(2-methylphenyl)-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide Traditional Name: 1-(o-tolyl)-3-p-phenetyl-2,5,6,7-tetrahydroimidazo[2,1-b][1,3]thiazin-4-ium-3-ol bromide Formula: C21H25BrN2O2S MolecularWeight: 449.4044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2(CN(C3=[N+]2CCCS3)C4=CC=CC=C4C)O.[Br-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2(CN(C3=[N+]2CCCS3)C4=CC=CC=C4C)O.[Br-]

InChI

InChI=1S/C21H25N2O2S.BrH/c1-3-25-18-11-9-17(10-12-18)21(24)15-22(19-8-5-4-7-16(19)2)20-23(21)13-6-14-26-20;/h4-5,7-12,24H,3,6,13-15H2,1-2H3;1H/q+1;/p-1