Trisodium 4-({4-chloro-6-[(3-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)-2-{[1-ethyl-2-hydroxy-4-methyl-6-oxo-5-(sulfonatomethyl)-1,6-dihydro-3-pyridinyl]diazenyl}benzenesulfonate
[CAS# 84045-63-6]

Identification

• Name: Trisodium 4-({4-chloro-6-[(3-sulfonatophenyl)amino]-1,3,5-triazin-2-yl}amino)-2-{[1-ethyl-2-hydroxy-4-methyl-6-oxo-5-(sulfonatomethyl)-1,6-dihydro-3-pyridinyl]diazenyl}benzenesulfonate
• Synonyms: trisodium 5-[[5-[[4-chloro-6-[(3-sulphonatophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-sulphonatophenyl]azo]-1-ethyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxopyridine-3-methanesulphonate
• Molecular Formula: C₂₄H₂₀ClN₈Na₃O₁₁S₃
• Molecular Weight: 797.08
• CAS Registry Number: 84045-63-6
• EINECS: 281-865-3
• SMILES: [Na+].[Na+].[Na+].O=C4C(/CS([O-])(=O)=O)=C(/C)\C(\N=Nc3cc(Nc2nc(Nc1cccc(c1)S([O-])(=O)=O)nc(Cl)n2)ccc3S([O-])(=O)=O)=C(\O)N4CC
• InChI: 1S/C24H23ClN8O11S3.3Na/c1-3-33-20(34)16(11-45(36,37)38)12(2)19(21(33)35)32-31-17-10-14(7-8-18(17)47(42,43)44)27-24-29-22(25)28-23(30-24)26-13-5-4-6-15(9-13)46(39,40)41;;;/h4-10,35H,3,11H2,1-2H3,(H,36,37,38)(H,39,40,41)(H,42,43,44)(H2,26,27,28,29,30);;;/q;3*+1/p-3
• InChIKey: IPMILRMSRPPRDU-UHFFFAOYSA-K