2-[2-azanyl-5-[(3-chlorophenyl)methyl]-1,3-thiazol-3-ium-3-yl]-1-phenyl-ethanone bromide

Systemtic Name: 2-[2-azanyl-5-[(3-chlorophenyl)methyl]-1,3-thiazol-3-ium-3-yl]-1-phenyl-ethanone bromide Openeye Name: 2-[2-amino-5-[(3-chlorophenyl)methyl]thiazol-3-ium-3-yl]-1-phenyl-ethanone bromide CAS Name: 2-[2-amino-5-[(3-chlorophenyl)methyl]-3-thiazol-3-iumyl]-1-phenylethanone bromide IUPAC Name: 2-[2-amino-5-[(3-chlorophenyl)methyl]-1,3-thiazol-3-ium-3-yl]-1-phenylethanone bromide Traditional Name: 2-[2-amino-5-(3-chlorobenzyl)thiazol-3-ium-3-yl]-1-phenyl-ethanone bromide Formula: C18H16BrClN2OS MolecularWeight: 423.75444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[N+]2=C(SC(=C2)CC3=CC(=CC=C3)Cl)N.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=C(SC(=C2)CC3=CC(=CC=C3)Cl)N.[Br-]

InChI

InChI=1S/C18H15ClN2OS.BrH/c19-15-8-4-5-13(9-15)10-16-11-21(18(20)23-16)12-17(22)14-6-2-1-3-7-14;/h1-9,11,20H,10,12H2;1H