3-chloranyl-2-phenyl-1,2-thiazol-2-ium chloride

Systemtic Name: 3-chloranyl-2-phenyl-1,2-thiazol-2-ium chloride Openeye Name: 3-chloro-2-phenyl-isothiazol-2-ium chloride CAS Name: 3-chloro-2-phenylisothiazol-2-ium chloride IUPAC Name: 3-chloro-2-phenyl-1,2-thiazol-2-ium chloride Traditional Name: 3-chloro-2-phenyl-isothiazol-2-ium chloride Formula: C9H7Cl2NS MolecularWeight: 232.12958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=C(C=CS2)Cl.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=C(C=CS2)Cl.[Cl-]

InChI

InChI=1S/C9H7ClNS.ClH/c10-9-6-7-12-11(9)8-4-2-1-3-5-8;/h1-7H;1H/q+1;/p-1