(2Z)-5-methoxy-3-methyl-2-[(1-methylpyridin-1-ium-2-yl)methylidene]-1,3-benzothiazole iodide

Systemtic Name: (2Z)-5-methoxy-3-methyl-2-[(1-methylpyridin-1-ium-2-yl)methylidene]-1,3-benzothiazole iodide Openeye Name: (2Z)-5-methoxy-3-methyl-2-[(1-methylpyridin-1-ium-2-yl)methylene]-1,3-benzothiazole iodide CAS Name: (2Z)-5-methoxy-3-methyl-2-[(1-methyl-2-pyridin-1-iumyl)methylidene]-1,3-benzothiazole iodide IUPAC Name: (2Z)-5-methoxy-3-methyl-2-[(1-methylpyridin-1-ium-2-yl)methylidene]-1,3-benzothiazole iodide Traditional Name: (2Z)-5-methoxy-3-methyl-2-[(1-methylpyridin-1-ium-2-yl)methylene]-1,3-benzothiazole iodide Formula: C16H17IN2OS MolecularWeight: 412.28845

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)OC)SC1=CC3=CC=CC=[N+]3C.[I-]

Isomeric SMILES

CN\1C2=C(C=CC(=C2)OC)S/C1=C\C3=CC=CC=[N+]3C.[I-]

InChI

InChI=1S/C16H17N2OS.HI/c1-17-9-5-4-6-12(17)10-16-18(2)14-11-13(19-3)7-8-15(14)20-16;/h4-11H,1-3H3;1H/q+1;/p-1