2-pyridin-1-ium-1-yl-1,3-benzothiazole chloride

Systemtic Name: 2-pyridin-1-ium-1-yl-1,3-benzothiazole chloride Openeye Name: 2-pyridin-1-ium-1-yl-1,3-benzothiazole chloride CAS Name: 2-(1-pyridin-1-iumyl)-1,3-benzothiazole chloride IUPAC Name: 2-pyridin-1-ium-1-yl-1,3-benzothiazole chloride Traditional Name: 2-pyridin-1-ium-1-yl-1,3-benzothiazole chloride Formula: C12H9ClN2S MolecularWeight: 248.73126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C2=NC3=CC=CC=C3S2.[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)C2=NC3=CC=CC=C3S2.[Cl-]

InChI

InChI=1S/C12H9N2S.ClH/c1-4-8-14(9-5-1)12-13-10-6-2-3-7-11(10)15-12;/h1-9H;1H/q+1;/p-1