2-(1,3-dihydro-1,2,3,4-tetrazol-3-ium-2-yl)-4,5-dimethyl-1,3-thiazole bromide

Systemtic Name: 2-(1,3-dihydro-1,2,3,4-tetrazol-3-ium-2-yl)-4,5-dimethyl-1,3-thiazole bromide Openeye Name: 2-(1,3-dihydrotetrazol-3-ium-2-yl)-4,5-dimethyl-thiazole bromide CAS Name: 2-(1,3-dihydrotetrazol-3-ium-2-yl)-4,5-dimethylthiazole bromide IUPAC Name: 2-(1,3-dihydrotetrazol-3-ium-2-yl)-4,5-dimethyl-1,3-thiazole bromide Traditional Name: 2-(1,3-dihydrotetrazol-3-ium-2-yl)-4,5-dimethyl-thiazole bromide Formula: C6H10BrN5S MolecularWeight: 264.1461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2[NH2+]N=CN2)C.[Br-]

Isomeric SMILES

CC1=C(SC(=N1)N2[NH2+]N=CN2)C.[Br-]

InChI

InChI=1S/C6H9N5S.BrH/c1-4-5(2)12-6(9-4)11-8-3-7-10-11;/h3,10H,1-2H3,(H,7,8);1H