Disodium 4-[(4-Amino-6-Chloro-1,3,5-Triazin-2-Yl)Amino]-2-[[4,5-Dihydro-3-Methyl-5-Oxo-1-(4-Sulphonatophenyl)-1H-Pyrazol-4-Yl]Azo]Benzenesulphonate
[CAS# 84100-05-0]

Identification

• Name: Disodium 4-[(4-Amino-6-Chloro-1,3,5-Triazin-2-Yl)Amino]-2-[[4,5-Dihydro-3-Methyl-5-Oxo-1-(4-Sulphonatophenyl)-1H-Pyrazol-4-Yl]Azo]Benzenesulphonate
• Synonyms: Disodium 4-[(4-Amino-6-Chloro-1,3,5-Triazin-2-Yl)Amino]-2-[[3-Methyl-5-Oxo-1-(4-Sulfonatophenyl)-4H-Pyrazol-4-Yl]Azo]Benzenesulfonate; Disodium 4-[(4-Amino-6-Chloro-S-Triazin-2-Yl)Amino]-2-[[5-Keto-3-Methyl-1-(4-Sulfonatophenyl)-4H-Pyrazol-4-Yl]Azo]Benzenesulfonate; Disodium 4-((4-Amino-6-Chloro-1,3,5-Triazin-2-Yl)Amino)-2-((4,5-Dihydro-3-Methyl-5-Oxo-1-(4-Sulphonatophenyl)-1H-Pyrazol-4-Yl)Azo)Benzenesulphonate
• Molecular Formula: C₁₉H₁₄ClN₉Na₂O₇S₂
• Molecular Weight: 625.93
• CAS Registry Number: 84100-05-0
• EINECS: 282-086-1
• SMILES: C2=C(NC1=NC(=NC(=N1)N)Cl)C=CC(=C2N=NC3C(=O)N(N=C3C)C4=CC=C([S]([O-])(=O)=O)C=C4)[S]([O-])(=O)=O.[Na+].[Na+]
• InChI: 1S/C19H16ClN9O7S2.2Na/c1-9-15(16(30)29(28-9)11-3-5-12(6-4-11)37(31,32)33)27-26-13-8-10(2-7-14(13)38(34,35)36)22-19-24-17(20)23-18(21)25-19;;/h2-8,15H,1H3,(H,31,32,33)(H,34,35,36)(H3,21,22,23,24,25);;/q;2*+1/p-2
• InChIKey: BMTKLUKLKZQLSB-UHFFFAOYSA-L