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

Systemtic Name: 2,5-dimethyl-3-prop-2-enyl-2H-1,3-benzothiazole iodide Openeye Name: 3-allyl-2,5-dimethyl-2H-1,3-benzothiazole iodide CAS Name: 2,5-dimethyl-3-prop-2-enyl-2H-1,3-benzothiazole iodide IUPAC Name: 2,5-dimethyl-3-prop-2-enyl-2H-1,3-benzothiazole iodide Traditional Name: 3-allyl-2,5-dimethyl-2H-1,3-benzothiazole iodide Formula: C12H15INS- MolecularWeight: 332.22367

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NS.HI/c1-4-7-13-10(3)14-12-6-5-9(2)8-11(12)13;/h4-6,8,10H,1,7H2,2-3H3;1H/p-1