Disodium 4-[3-Methyl-4-[4-[[4-[[3-Methyl-5-Oxo-1-(4-Sulfonatophenyl)-4H-Pyrazol-4-Yl]Diazenyl]Benzoyl]Amino]Phenyl]Diazenyl-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonate
[CAS# 72829-13-1]

Identification

• Name: Disodium 4-[3-Methyl-4-[4-[[4-[[3-Methyl-5-Oxo-1-(4-Sulfonatophenyl)-4H-Pyrazol-4-Yl]Diazenyl]Benzoyl]Amino]Phenyl]Diazenyl-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonate
• Synonyms: Disodium 4-[3-Methyl-4-[4-[[4-[[3-Methyl-5-Oxo-1-(4-Sulfonatophenyl)-4H-Pyrazol-4-Yl]Azo]Benzoyl]Amino]Phenyl]Azo-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonate; Disodium 4-[3-Methyl-4-[4-[[[4-[[3-Methyl-5-Oxo-1-(4-Sulfonatophenyl)-4H-Pyrazol-4-Yl]Azo]Phenyl]-Oxomethyl]Amino]Phenyl]Azo-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonate; Disodium 4-[5-Keto-4-[4-[[4-[[5-Keto-3-Methyl-1-(4-Sulfonatophenyl)-4H-Pyrazol-4-Yl]Azo]Benzoyl]Amino]Phenyl]Azo-3-Methyl-4H-Pyrazol-1-Yl]Benzenesulfonate
• Molecular Formula: C₃₃H₂₅N₉Na₂O₉S₂
• Molecular Weight: 801.71
• CAS Registry Number: 72829-13-1
• EINECS: 276-905-1
• SMILES: C6=C(N5N=C(C(N=NC4=CC=C(C(=O)NC3=CC=C(N=NC1C(=O)N(N=C1C)C2=CC=C([S]([O-])(=O)=O)C=C2)C=C3)C=C4)C5=O)C)C=CC(=C6)[S]([O-])(=O)=O.[Na+].[Na+]
• InChI: 1S/C33H27N9O9S2.2Na/c1-19-29(32(44)41(39-19)25-11-15-27(16-12-25)52(46,47)48)37-35-23-5-3-21(4-6-23)31(43)34-22-7-9-24(10-8-22)36-38-30-20(2)40-42(33(30)45)26-13-17-28(18-14-26)53(49,50)51;;/h3-18,29-30H,1-2H3,(H,34,43)(H,46,47,48)(H,49,50,51);;/q;2*+1/p-2
• InChIKey: ZAKDIUJDZSMNSX-UHFFFAOYSA-L