2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-phenyl-ethanone chloride

Systemtic Name: 2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-phenyl-ethanone chloride Openeye Name: 2-(4,5-dimethylthiazol-3-ium-3-yl)-1-phenyl-ethanone chloride CAS Name: 2-(4,5-dimethyl-3-thiazol-3-iumyl)-1-phenylethanone chloride IUPAC Name: 2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-phenylethanone chloride Traditional Name: 2-(4,5-dimethylthiazol-3-ium-3-yl)-1-phenyl-ethanone chloride Formula: C13H14ClNOS MolecularWeight: 267.77436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC(=O)C2=CC=CC=C2)C.[Cl-]

Isomeric SMILES

CC1=C(SC=[N+]1CC(=O)C2=CC=CC=C2)C.[Cl-]

InChI

InChI=1S/C13H14NOS.ClH/c1-10-11(2)16-9-14(10)8-13(15)12-6-4-3-5-7-12;/h3-7,9H,8H2,1-2H3;1H/q+1;/p-1