1-(4-phenylpiperazin-1-yl)-2-(1,3-thiazol-3-ium-3-yl)ethanone bromide

Systemtic Name: 1-(4-phenylpiperazin-1-yl)-2-(1,3-thiazol-3-ium-3-yl)ethanone bromide Openeye Name: 1-(4-phenylpiperazin-1-yl)-2-thiazol-3-ium-3-yl-ethanone bromide CAS Name: 1-(4-phenyl-1-piperazinyl)-2-(3-thiazol-3-iumyl)ethanone bromide IUPAC Name: 1-(4-phenylpiperazin-1-yl)-2-(1,3-thiazol-3-ium-3-yl)ethanone bromide Traditional Name: 1-(4-phenylpiperazino)-2-thiazol-3-ium-3-yl-ethanone bromide Formula: C15H18BrN3OS MolecularWeight: 368.29192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C[N+]3=CSC=C3.[Br-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C[N+]3=CSC=C3.[Br-]

InChI

InChI=1S/C15H18N3OS.BrH/c19-15(12-16-10-11-20-13-16)18-8-6-17(7-9-18)14-4-2-1-3-5-14;/h1-5,10-11,13H,6-9,12H2;1H/q+1;/p-1