4,5-dimethyl-3-(phenylmethyl)-1,3-thiazol-3-ium chloride

Systemtic Name: 4,5-dimethyl-3-(phenylmethyl)-1,3-thiazol-3-ium chloride Openeye Name: 3-benzyl-4,5-dimethyl-thiazol-3-ium chloride CAS Name: 4,5-dimethyl-3-(phenylmethyl)thiazol-3-ium chloride IUPAC Name: 3-benzyl-4,5-dimethyl-1,3-thiazol-3-ium chloride Traditional Name: 3-benzyl-4,5-dimethyl-thiazol-3-ium chloride Formula: C12H14ClNS MolecularWeight: 239.76426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14NS.ClH/c1-10-11(2)14-9-13(10)8-12-6-4-3-5-7-12;/h3-7,9H,8H2,1-2H3;1H/q+1;/p-1