Bis{6-methoxy-3-methyl-2-[(1E)-3-methyl-3-(4-nitrophenyl)-1-triazen-1-yl]-1,3-benzothiazol-3-ium} sulfate
[CAS# 89923-58-0]

Identification

• Name: Bis{6-methoxy-3-methyl-2-[(1E)-3-methyl-3-(4-nitrophenyl)-1-triazen-1-yl]-1,3-benzothiazol-3-ium} sulfate
• Synonyms: Benzothiazolium, 6-methoxy-3-methyl-2-(3-methyl-3-(4-nitrophenyl)-1-triazenyl)-, sulfate (2:1); Bis(6-methoxy-3-methyl-2-(3-methyl-3-(4-nitrophenyl)triazen-1-yl)benzothiazolium) sulphate
• Molecular Formula: C₃₂H₃₂N₁₀O₁₀S₃
• Molecular Weight: 812.85
• CAS Registry Number: 89923-58-0
• EINECS: 289-548-1
• SMILES: [O-]S([O-])(=O)=O.[O-][N+](=O)c1ccc(cc1)N(/N=N/c3sc2cc(OC)ccc2[n+]3C)C.[O-][N+](=O)c1ccc(cc1)N(/N=N/c3sc2cc(OC)ccc2[n+]3C)C
• InChI: 1S/2C16H16N5O3S.H2O4S/c2*1-19-14-9-8-13(24-3)10-15(14)25-16(19)17-18-20(2)11-4-6-12(7-5-11)21(22)23;1-5(2,3)4/h2*4-10H,1-3H3;(H2,1,2,3,4)/q2*+1;/p-2
• InChIKey: OPWUSWFYSMOOAW-UHFFFAOYSA-L