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

Systemtic Name: 3-ethyl-2-phenyl-1,3-benzothiazol-3-ium Openeye Name: 3-ethyl-2-phenyl-1,3-benzothiazol-3-ium CAS Name: 3-ethyl-2-phenyl-1,3-benzothiazol-3-ium IUPAC Name: 3-ethyl-2-phenyl-1,3-benzothiazol-3-ium Traditional Name: 3-ethyl-2-phenyl-1,3-benzothiazol-3-ium Formula: C15H14NS+ MolecularWeight: 240.34336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14NS/c1-2-16-13-10-6-7-11-14(13)17-15(16)12-8-4-3-5-9-12/h3-11H,2H2,1H3/q+1