4-(4-methoxyphenyl)-N,5-diphenyl-1,3-thiazol-3-ium-2-amine bromide

Systemtic Name: 4-(4-methoxyphenyl)-N,5-diphenyl-1,3-thiazol-3-ium-2-amine bromide Openeye Name: 4-(4-methoxyphenyl)-N,5-diphenyl-thiazol-3-ium-2-amine bromide CAS Name: 4-(4-methoxyphenyl)-N,5-diphenyl-2-thiazol-3-iumamine bromide IUPAC Name: 4-(4-methoxyphenyl)-N,5-diphenyl-1,3-thiazol-3-ium-2-amine bromide Traditional Name: [4-(4-methoxyphenyl)-5-phenyl-thiazol-3-ium-2-yl]-phenyl-amine bromide Formula: C22H19BrN2OS MolecularWeight: 439.36806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(SC(=[NH+]2)NC3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(SC(=[NH+]2)NC3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C22H18N2OS.BrH/c1-25-19-14-12-16(13-15-19)20-21(17-8-4-2-5-9-17)26-22(24-20)23-18-10-6-3-7-11-18;/h2-15H,1H3,(H,23,24);1H