2-(4,5-diethyl-1,3-thiazol-3-ium-3-yl)-1-pyrrolidin-1-yl-ethanone bromide

Systemtic Name: 2-(4,5-diethyl-1,3-thiazol-3-ium-3-yl)-1-pyrrolidin-1-yl-ethanone bromide Openeye Name: 2-(4,5-diethylthiazol-3-ium-3-yl)-1-pyrrolidin-1-yl-ethanone bromide CAS Name: 2-(4,5-diethyl-3-thiazol-3-iumyl)-1-(1-pyrrolidinyl)ethanone bromide IUPAC Name: 2-(4,5-diethyl-1,3-thiazol-3-ium-3-yl)-1-pyrrolidin-1-ylethanone bromide Traditional Name: 2-(4,5-diethylthiazol-3-ium-3-yl)-1-pyrrolidino-ethanone bromide Formula: C13H21BrN2OS MolecularWeight: 333.28764

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=[N+]1CC(=O)N2CCCC2)CC.[Br-]

Isomeric SMILES

CCC1=C(SC=[N+]1CC(=O)N2CCCC2)CC.[Br-]

InChI

InChI=1S/C13H21N2OS.BrH/c1-3-11-12(4-2)17-10-15(11)9-13(16)14-7-5-6-8-14;/h10H,3-9H2,1-2H3;1H/q+1;/p-1