2,3-dimethyl-5-prop-2-ynoxy-2H-1,3-benzothiazole iodide

Systemtic Name: 2,3-dimethyl-5-prop-2-ynoxy-2H-1,3-benzothiazole iodide Openeye Name: 2,3-dimethyl-5-prop-2-ynoxy-2H-1,3-benzothiazole iodide CAS Name: 2,3-dimethyl-5-prop-2-ynoxy-2H-1,3-benzothiazole iodide IUPAC Name: 2,3-dimethyl-5-prop-2-ynoxy-2H-1,3-benzothiazole iodide Traditional Name: 2,3-dimethyl-5-propargyloxy-2H-1,3-benzothiazole iodide Formula: C12H13INOS- MolecularWeight: 346.20719

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(C2=C(S1)C=CC(=C2)OCC#C)C.[I-]

Isomeric SMILES

CC1N(C2=C(S1)C=CC(=C2)OCC#C)C.[I-]

InChI

InChI=1S/C12H13NOS.HI/c1-4-7-14-10-5-6-12-11(8-10)13(3)9(2)15-12;/h1,5-6,8-9H,7H2,2-3H3;1H/p-1