2-(4,5-dimethylthiophen-2-yl)-3,5-diphenyl-1,2,3,4-tetrazol-2-ium bromide

Systemtic Name: 2-(4,5-dimethylthiophen-2-yl)-3,5-diphenyl-1,2,3,4-tetrazol-2-ium bromide Openeye Name: 2-(4,5-dimethyl-2-thienyl)-3,5-diphenyl-tetrazol-2-ium bromide CAS Name: 2-(4,5-dimethyl-2-thiophenyl)-3,5-diphenyltetrazol-2-ium bromide IUPAC Name: 2-(4,5-dimethylthiophen-2-yl)-3,5-diphenyltetrazol-2-ium bromide Traditional Name: 2-(4,5-dimethyl-2-thienyl)-3,5-diphenyl-tetrazol-2-ium bromide Formula: C19H17BrN4S MolecularWeight: 413.33408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)[N+]2=NC(=NN2C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]

Isomeric SMILES

CC1=C(SC(=C1)[N+]2=NC(=NN2C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]

InChI

InChI=1S/C19H17N4S.BrH/c1-14-13-18(24-15(14)2)23-21-19(16-9-5-3-6-10-16)20-22(23)17-11-7-4-8-12-17;/h3-13H,1-2H3;1H/q+1;/p-1