3-methyl-1,3-benzothiazol-3-ium-2-amine iodide

Systemtic Name: 3-methyl-1,3-benzothiazol-3-ium-2-amine iodide Openeye Name: 3-methyl-1,3-benzothiazol-3-ium-2-amine iodide CAS Name: 3-methyl-1,3-benzothiazol-3-ium-2-amine iodide IUPAC Name: 3-methyl-1,3-benzothiazol-3-ium-2-amine iodide Traditional Name: (3-methyl-1,3-benzothiazol-3-ium-2-yl)amine iodide Formula: C8H9IN2S MolecularWeight: 292.13993

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC2=CC=CC=C21)N.[I-]

Isomeric SMILES

C[N+]1=C(SC2=CC=CC=C21)N.[I-]

InChI

InChI=1S/C8H8N2S.HI/c1-10-6-4-2-3-5-7(6)11-8(10)9;/h2-5,9H,1H3;1H