Disodium 2,5-Dichloro-4-[4-[5-[(5-Chloro-2,6-Difluoropyrimidin-4-Yl)Amino]-2-Sulfonatophenyl]Diazenyl-3-Methyl-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonate
[CAS# 72379-41-0]

Identification

• Name: Disodium 2,5-Dichloro-4-[4-[5-[(5-Chloro-2,6-Difluoropyrimidin-4-Yl)Amino]-2-Sulfonatophenyl]Diazenyl-3-Methyl-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonate
• Synonyms: Disodium 2,5-Dichloro-4-[4-[5-[(5-Chloro-2,6-Difluoro-Pyrimidin-4-Yl)Amino]-2-Sulfonato-Phenyl]Azo-3-Methyl-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonate; Disodium 2,5-Dichloro-4-[4-[5-[(5-Chloro-2,6-Difluoro-4-Pyrimidinyl)Amino]-2-Sulfonatophenyl]Azo-3-Methyl-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonate; Disodium 2,5-Dichloro-4-[4-[5-[(5-Chloro-2,6-Difluoro-Pyrimidin-4-Yl)Amino]-2-Sulfonato-Phenyl]Azo-5-Keto-3-Methyl-4H-Pyrazol-1-Yl]Benzenesulfonate
• Molecular Formula: C₂₀H₁₀Cl₃F₂N₇Na₂O₇S₂
• Molecular Weight: 714.80
• CAS Registry Number: 72379-41-0
• EINECS: 276-618-1
• SMILES: C1=C(Cl)C(=CC(=C1N4N=C(C(N=NC2=CC(=CC=C2[S]([O-])(=O)=O)NC3=NC(=NC(=C3Cl)F)F)C4=O)C)Cl)[S]([O-])(=O)=O.[Na+].[Na+]
• InChI: 1S/C20H12Cl3F2N7O7S2.2Na/c1-7-16(19(33)32(31-7)12-5-10(22)14(6-9(12)21)41(37,38)39)30-29-11-4-8(2-3-13(11)40(34,35)36)26-18-15(23)17(24)27-20(25)28-18;;/h2-6,16H,1H3,(H,26,27,28)(H,34,35,36)(H,37,38,39);;/q;2*+1/p-2
• InChIKey: HQDXRVBGELSFMO-UHFFFAOYSA-L