3-methyl-2-[(E)-2-phenylethenyl]-2H-1,3-benzothiazole iodide

Systemtic Name: 3-methyl-2-[(E)-2-phenylethenyl]-2H-1,3-benzothiazole iodide Openeye Name: 3-methyl-2-[(E)-styryl]-2H-1,3-benzothiazole iodide CAS Name: 3-methyl-2-[(E)-2-phenylethenyl]-2H-1,3-benzothiazole iodide IUPAC Name: 3-methyl-2-[(E)-2-phenylethenyl]-2H-1,3-benzothiazole iodide Traditional Name: 3-methyl-2-[(E)-styryl]-2H-1,3-benzothiazole iodide Formula: C16H15INS- MolecularWeight: 380.26647

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(SC2=CC=CC=C21)C=CC3=CC=CC=C3.[I-]

Isomeric SMILES

CN1C(SC2=CC=CC=C21)/C=C/C3=CC=CC=C3.[I-]

InChI

InChI=1S/C16H15NS.HI/c1-17-14-9-5-6-10-15(14)18-16(17)12-11-13-7-3-2-4-8-13;/h2-12,16H,1H3;1H/p-1/b12-11+;