3,6-dimethyl-1,3-benzothiazol-3-ium iodide

Systemtic Name: 3,6-dimethyl-1,3-benzothiazol-3-ium iodide Openeye Name: 3,6-dimethyl-1,3-benzothiazol-3-ium iodide CAS Name: 3,6-dimethyl-1,3-benzothiazol-3-ium iodide IUPAC Name: 3,6-dimethyl-1,3-benzothiazol-3-ium iodide Traditional Name: 3,6-dimethyl-1,3-benzothiazol-3-ium iodide Formula: C9H10INS MolecularWeight: 291.15187

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[N+](=CS2)C.[I-]

Isomeric SMILES

CC1=CC2=C(C=C1)[N+](=CS2)C.[I-]

InChI

InChI=1S/C9H10NS.HI/c1-7-3-4-8-9(5-7)11-6-10(8)2;/h3-6H,1-2H3;1H/q+1;/p-1