2,4-dimethyl-1,3-thiazole; 3,5-diphenyl-2H-1,2,3,4-tetrazol-3-ium; bromide

Systemtic Name: 2,4-dimethyl-1,3-thiazole; 3,5-diphenyl-2H-1,2,3,4-tetrazol-3-ium; bromide Openeye Name: 2,4-dimethylthiazole; 3,5-diphenyl-2H-tetrazol-3-ium; bromide CAS Name: 2,4-dimethylthiazole; 3,5-diphenyl-2H-tetrazol-3-ium; bromide IUPAC Name: 2,4-dimethyl-1,3-thiazole; 3,5-diphenyl-2H-tetrazol-3-ium; bromide Traditional Name: 2,4-dimethylthiazole; 3,5-diphenyl-2H-tetrazol-3-ium; bromide Formula: C18H18BrN5S MolecularWeight: 416.33802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C.C1=CC=C(C=C1)C2=NN[N+](=N2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CC1=CSC(=N1)C.C1=CC=C(C=C1)C2=NN[N+](=N2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C13H10N4.C5H7NS.BrH/c1-3-7-11(8-4-1)13-14-16-17(15-13)12-9-5-2-6-10-12;1-4-3-7-5(2)6-4;/h1-10H;3H,1-2H3;1H