2-(5-decyl-1,3-thiazol-3-ium-3-yl)-1-(furan-2-yl)ethanone bromide

Systemtic Name: 2-(5-decyl-1,3-thiazol-3-ium-3-yl)-1-(furan-2-yl)ethanone bromide Openeye Name: 2-(5-decylthiazol-3-ium-3-yl)-1-(2-furyl)ethanone bromide CAS Name: 2-(5-decyl-3-thiazol-3-iumyl)-1-(2-furanyl)ethanone bromide IUPAC Name: 2-(5-decyl-1,3-thiazol-3-ium-3-yl)-1-(furan-2-yl)ethanone bromide Traditional Name: 2-(5-decylthiazol-3-ium-3-yl)-1-(2-furyl)ethanone bromide Formula: C19H28BrNO2S MolecularWeight: 414.40012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=C[N+](=CS1)CC(=O)C2=CC=CO2.[Br-]

Isomeric SMILES

CCCCCCCCCCC1=C[N+](=CS1)CC(=O)C2=CC=CO2.[Br-]

InChI

InChI=1S/C19H28NO2S.BrH/c1-2-3-4-5-6-7-8-9-11-17-14-20(16-23-17)15-18(21)19-12-10-13-22-19;/h10,12-14,16H,2-9,11,15H2,1H3;1H/q+1;/p-1