Sodium 2,5-Dichloro-4-[4,5-Dihydro-3-Methyl-5-Oxo-4-[[3-[(Phenylsulphonyl)Amino]Phenyl]Azo]-1H-Pyrazol-1-Yl]Benzenesulphonate
[CAS# 84434-54-8]

Identification

• Name: Sodium 2,5-Dichloro-4-[4,5-Dihydro-3-Methyl-5-Oxo-4-[[3-[(Phenylsulphonyl)Amino]Phenyl]Azo]-1H-Pyrazol-1-Yl]Benzenesulphonate
• Synonyms: Sodium 2,5-Dichloro-4-[3-Methyl-5-Oxo-4-[3-(Phenylsulfonylamino)Phenyl]Azo-4H-Pyrazol-1-Yl]Benzenesulfonate; Sodium 2,5-Dichloro-4-[5-Keto-3-Methyl-4-[3-(Phenylsulfonylamino)Phenyl]Azo-4H-Pyrazol-1-Yl]Benzenesulfonate
• Molecular Formula: C₂₂H₁₆Cl₂N₅NaO₆S₂
• Molecular Weight: 604.41
• CAS Registry Number: 84434-54-8
• EINECS: 282-854-6
• SMILES: C4=C(N3N=C(C(N=NC1=CC(=CC=C1)N[S](=O)(=O)C2=CC=CC=C2)C3=O)C)C(=CC(=C4Cl)[S]([O-])(=O)=O)Cl.[Na+]
• InChI: 1S/C22H17Cl2N5O6S2.Na/c1-13-21(22(30)29(27-13)19-11-18(24)20(12-17(19)23)37(33,34)35)26-25-14-6-5-7-15(10-14)28-36(31,32)16-8-3-2-4-9-16;/h2-12,21,28H,1H3,(H,33,34,35);/q;+1/p-1
• InChIKey: XBDKVDCEXJLDDK-UHFFFAOYSA-M