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

Systemtic Name: 2-(2,4-diphenyl-1H-1,2,3,4-tetrazol-4-ium-3-yl)-4,5-diethyl-1,3-thiazole bromide Openeye Name: 2-(2,4-diphenyl-1H-tetrazol-4-ium-3-yl)-4,5-diethyl-thiazole bromide CAS Name: 2-(2,4-diphenyl-1H-tetrazol-4-ium-3-yl)-4,5-diethylthiazole bromide IUPAC Name: 2-(2,4-diphenyl-1H-tetrazol-4-ium-3-yl)-4,5-diethyl-1,3-thiazole bromide Traditional Name: 2-(2,4-diphenyl-1H-tetrazol-4-ium-3-yl)-4,5-diethyl-thiazole bromide Formula: C20H22BrN5S MolecularWeight: 444.39118

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)N2N(NC=[N+]2C3=CC=CC=C3)C4=CC=CC=C4)CC.[Br-]

Isomeric SMILES

CCC1=C(SC(=N1)N2N(NC=[N+]2C3=CC=CC=C3)C4=CC=CC=C4)CC.[Br-]

InChI

InChI=1S/C20H21N5S.BrH/c1-3-18-19(4-2)26-20(22-18)25-23(16-11-7-5-8-12-16)15-21-24(25)17-13-9-6-10-14-17;/h5-15H,3-4H2,1-2H3;1H