Trisodium 4-[[4-Chloro-6-[(3-Sulphonatophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-2-[[1-(2,5-Dichloro-4-Sulphonatophenyl)-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-4-Yl]Azo]Benzenesulphonate
[CAS# 72259-17-7]

Identification

• Name: Trisodium 4-[[4-Chloro-6-[(3-Sulphonatophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-2-[[1-(2,5-Dichloro-4-Sulphonatophenyl)-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-4-Yl]Azo]Benzenesulphonate
• Synonyms: Trisodium 2,5-Dichloro-4-[4-[5-[[4-Chloro-6-[(3-Sulfonatophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonato-Phenyl]Azo-3-Methyl-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonate; Trisodium 2,5-Dichloro-4-[4-[5-[[4-Chloro-6-[(3-Sulfonatophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonatophenyl]Azo-3-Methyl-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonate; Trisodium 2,5-Dichloro-4-[4-[5-[[4-Chloro-6-[(3-Sulfonatophenyl)Amino]-S-Triazin-2-Yl]Amino]-2-Sulfonato-Phenyl]Azo-5-Keto-3-Methyl-4H-Pyrazol-1-Yl]Benzenesulfonate
• Molecular Formula: C₂₅H₁₅Cl₃N₉Na₃O₁₀S₃
• Molecular Weight: 872.96
• CAS Registry Number: 72259-17-7
• EINECS: 276-548-1
• SMILES: C5=C(N4N=C(C(N=NC1=CC(=CC=C1[S]([O-])(=O)=O)NC2=NC(=NC(=N2)NC3=CC=CC(=C3)[S]([O-])(=O)=O)Cl)C4=O)C)C(=CC(=C5Cl)[S]([O-])(=O)=O)Cl.[Na+].[Na+].[Na+]
• InChI: 1S/C25H18Cl3N9O10S3.3Na/c1-11-21(22(38)37(36-11)18-9-16(27)20(10-15(18)26)50(45,46)47)35-34-17-8-13(5-6-19(17)49(42,43)44)30-25-32-23(28)31-24(33-25)29-12-3-2-4-14(7-12)48(39,40)41;;;/h2-10,21H,1H3,(H,39,40,41)(H,42,43,44)(H,45,46,47)(H2,29,30,31,32,33);;;/q;3*+1/p-3
• InChIKey: CMHGGMYOTLMJTR-UHFFFAOYSA-K