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

Systemtic Name: 2-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]ethanenitrile bromide Openeye Name: 2-[5-(2-hydroxyethyl)-4-methyl-thiazol-3-ium-3-yl]acetonitrile bromide CAS Name: 2-[5-(2-hydroxyethyl)-4-methyl-3-thiazol-3-iumyl]acetonitrile bromide IUPAC Name: 2-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]acetonitrile bromide Traditional Name: 2-[5-(2-hydroxyethyl)-4-methyl-thiazol-3-ium-3-yl]acetonitrile bromide Formula: C8H11BrN2OS MolecularWeight: 263.15474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11N2OS.BrH/c1-7-8(2-5-11)12-6-10(7)4-3-9;/h6,11H,2,4-5H2,1H3;1H/q+1;/p-1