2-[4-methyl-3-(phenylmethyl)-1,3-thiazol-3-ium-5-yl]ethanol bromide

Systemtic Name: 2-[4-methyl-3-(phenylmethyl)-1,3-thiazol-3-ium-5-yl]ethanol bromide Openeye Name: 2-(3-benzyl-4-methyl-thiazol-3-ium-5-yl)ethanol bromide CAS Name: 2-[4-methyl-3-(phenylmethyl)-5-thiazol-3-iumyl]ethanol bromide IUPAC Name: 2-(3-benzyl-4-methyl-1,3-thiazol-3-ium-5-yl)ethanol bromide Traditional Name: 2-(3-benzyl-4-methyl-thiazol-3-ium-5-yl)ethanol bromide Formula: C13H16BrNOS MolecularWeight: 314.24124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC2=CC=CC=C2)CCO.[Br-]

Isomeric SMILES

CC1=C(SC=[N+]1CC2=CC=CC=C2)CCO.[Br-]

InChI

InChI=1S/C13H16NOS.BrH/c1-11-13(7-8-15)16-10-14(11)9-12-5-3-2-4-6-12;/h2-6,10,15H,7-9H2,1H3;1H/q+1;/p-1