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

Systemtic Name: (2-azanyl-4-bromanyl-3,4-diphenyl-5H-1,3-thiazol-3-ium-5-yl)-phenyl-methanone bromide Openeye Name: (2-amino-4-bromo-3,4-diphenyl-5H-thiazol-3-ium-5-yl)-phenyl-methanone bromide CAS Name: (2-amino-4-bromo-3,4-diphenyl-5H-thiazol-3-ium-5-yl)-phenylmethanone bromide IUPAC Name: (2-amino-4-bromo-3,4-diphenyl-5H-1,3-thiazol-3-ium-5-yl)-phenylmethanone bromide Traditional Name: (2-amino-4-bromo-3,4-diphenyl-2-thiazolin-3-ium-5-yl)-phenyl-methanone bromide Formula: C22H18Br2N2OS MolecularWeight: 518.26412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2C([N+](=C(S2)N)C3=CC=CC=C3)(C4=CC=CC=C4)Br.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2C([N+](=C(S2)N)C3=CC=CC=C3)(C4=CC=CC=C4)Br.[Br-]

InChI

InChI=1S/C22H17BrN2OS.BrH/c23-22(17-12-6-2-7-13-17)20(19(26)16-10-4-1-5-11-16)27-21(24)25(22)18-14-8-3-9-15-18;/h1-15,20,24H;1H