[2-azanyl-4-bromanyl-4-(4-methylphenyl)-3-phenyl-5H-1,3-thiazol-3-ium-5-yl]-phenyl-methanone bromide

Systemtic Name: [2-azanyl-4-bromanyl-4-(4-methylphenyl)-3-phenyl-5H-1,3-thiazol-3-ium-5-yl]-phenyl-methanone bromide Openeye Name: [2-amino-4-bromo-3-phenyl-4-(p-tolyl)-5H-thiazol-3-ium-5-yl]-phenyl-methanone bromide CAS Name: [2-amino-4-bromo-4-(4-methylphenyl)-3-phenyl-5H-thiazol-3-ium-5-yl]-phenylmethanone bromide IUPAC Name: [2-amino-4-bromo-4-(4-methylphenyl)-3-phenyl-5H-1,3-thiazol-3-ium-5-yl]-phenylmethanone bromide Traditional Name: [2-amino-4-bromo-3-phenyl-4-(p-tolyl)-2-thiazolin-3-ium-5-yl]-phenyl-methanone bromide Formula: C23H20Br2N2OS MolecularWeight: 532.2907

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(C(SC(=[N+]2C3=CC=CC=C3)N)C(=O)C4=CC=CC=C4)Br.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C2(C(SC(=[N+]2C3=CC=CC=C3)N)C(=O)C4=CC=CC=C4)Br.[Br-]

InChI

InChI=1S/C23H19BrN2OS.BrH/c1-16-12-14-18(15-13-16)23(24)21(20(27)17-8-4-2-5-9-17)28-22(25)26(23)19-10-6-3-7-11-19;/h2-15,21,25H,1H3;1H