Benzenesulfonic acid, 4-[[4-chloro-6-[(2-methyl-4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-[[1-(2,5-dichloro-4-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]-, trisodium salt

CAS Name

Benzenesulfonic acid, 4-[[4-chloro-6-[(2-methyl-4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-[2-[1-(2,5-dichloro-4-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-, sodium salt (1:3)

Molecular Formula

C₂₆H₂₀Cl₃N₉O₁₀S₃.3Na

Molecular Mass

890.02

Other Names and Identifiers

InChI

InChI=1S/C26H20Cl3N9O10S3.3Na/c1-11-7-14(49(40,41)42)4-5-17(11)31-26-33-24(29)32-25(34-26)30-13-3-6-20(50(43,44)45)18(8-13)35-36-22-12(2)37-38(23(22)39)19-9-16(28)21(10-15(19)27)51(46,47)48;;;/h3-10,22H,1-2H3,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,30,31,32,33,34);;;

InChIKey

InChIKey=MEVPPCSSXYWTIX-UHFFFAOYSA-N

Canonical SMILES

[Na].O=C1N(N=C(C)C1N=NC2=CC(=CC=C2S(=O)(=O)O)NC3=NC(Cl)=NC(=N3)NC4=CC=C(C=C4C)S(=O)(=O)O)C5=CC(Cl)=C(C=C5Cl)S(=O)(=O)O

Other Names for this Substance