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

Systemtic Name: 2-(2,5-diphenyl-1,2,3,4-tetrazol-1-ium-1-yl)-4-methyl-1,3-thiazole bromide Openeye Name: 2-(2,5-diphenyltetrazol-1-ium-1-yl)-4-methyl-thiazole bromide CAS Name: 2-(2,5-diphenyl-1-tetrazol-1-iumyl)-4-methylthiazole bromide IUPAC Name: 2-(2,5-diphenyltetrazol-1-ium-1-yl)-4-methyl-1,3-thiazole bromide Traditional Name: 2-(2,5-diphenyltetrazol-1-ium-1-yl)-4-methyl-thiazole bromide Formula: C17H14BrN5S MolecularWeight: 400.29556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)[N+]2=C(N=NN2C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC1=CSC(=N1)[N+]2=C(N=NN2C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C17H14N5S.BrH/c1-13-12-23-17(18-13)21-16(14-8-4-2-5-9-14)19-20-22(21)15-10-6-3-7-11-15;/h2-12H,1H3;1H/q+1;/p-1