3-methyl-2-(2-thiophen-2-ylethenyl)-1,3-benzothiazol-3-ium

Systemtic Name: 3-methyl-2-(2-thiophen-2-ylethenyl)-1,3-benzothiazol-3-ium Openeye Name: 3-methyl-2-[2-(2-thienyl)vinyl]-1,3-benzothiazol-3-ium CAS Name: 3-methyl-2-(2-thiophen-2-ylethenyl)-1,3-benzothiazol-3-ium IUPAC Name: 3-methyl-2-(2-thiophen-2-ylethenyl)-1,3-benzothiazol-3-ium Traditional Name: 3-methyl-2-[2-(2-thienyl)vinyl]-1,3-benzothiazol-3-ium Formula: C14H12NS2+ MolecularWeight: 258.38178

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC2=CC=CC=C21)C=CC3=CC=CS3

Isomeric SMILES

C[N+]1=C(SC2=CC=CC=C21)C=CC3=CC=CS3

InChI

InChI=1S/C14H12NS2/c1-15-12-6-2-3-7-13(12)17-14(15)9-8-11-5-4-10-16-11/h2-10H,1H3/q+1