3-ethyl-6-methoxy-2,5-dimethyl-2H-1,3-benzothiazole iodide

Systemtic Name: 3-ethyl-6-methoxy-2,5-dimethyl-2H-1,3-benzothiazole iodide Openeye Name: 3-ethyl-6-methoxy-2,5-dimethyl-2H-1,3-benzothiazole iodide CAS Name: 3-ethyl-6-methoxy-2,5-dimethyl-2H-1,3-benzothiazole iodide IUPAC Name: 3-ethyl-6-methoxy-2,5-dimethyl-2H-1,3-benzothiazole iodide Traditional Name: 3-ethyl-6-methoxy-2,5-dimethyl-2H-1,3-benzothiazole iodide Formula: C12H17INOS- MolecularWeight: 350.23895

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(SC2=C1C=C(C(=C2)OC)C)C.[I-]

Isomeric SMILES

CCN1C(SC2=C1C=C(C(=C2)OC)C)C.[I-]

InChI

InChI=1S/C12H17NOS.HI/c1-5-13-9(3)15-12-7-11(14-4)8(2)6-10(12)13;/h6-7,9H,5H2,1-4H3;1H/p-1