3-methyl-2-phenyl-1,3-benzothiazol-3-ium

Systemtic Name: 3-methyl-2-phenyl-1,3-benzothiazol-3-ium Openeye Name: 3-methyl-2-phenyl-1,3-benzothiazol-3-ium CAS Name: 3-methyl-2-phenyl-1,3-benzothiazol-3-ium IUPAC Name: 3-methyl-2-phenyl-1,3-benzothiazol-3-ium Traditional Name: 3-methyl-2-phenyl-1,3-benzothiazol-3-ium Formula: C14H12NS+ MolecularWeight: 226.31678

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

C[N+]1=C(SC2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C14H12NS/c1-15-12-9-5-6-10-13(12)16-14(15)11-7-3-2-4-8-11/h2-10H,1H3/q+1