2-[4-[[[1-(Hydroxymethyl)-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol]-4-Yl]Azo]Phenyl]-6-Methyl-7-Benzothiazolesulfonic Acid Sodium Salt
[CAS# 25983-65-7]

Identification

• Name: 2-[4-[[[1-(Hydroxymethyl)-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol]-4-Yl]Azo]Phenyl]-6-Methyl-7-Benzothiazolesulfonic Acid Sodium Salt
• Synonyms: Sodium 2-[4-[[1-(Hydroxymethyl)-3-Methyl-5-Oxo-4H-Pyrazol-4-Yl]Azo]Phenyl]-6-Methyl-1,3-Benzothiazole-7-Sulfonate; Sodium 2-[4-[(5-Keto-3-Methyl-1-Methylol-4H-Pyrazol-4-Yl)Azo]Phenyl]-6-Methyl-1,3-Benzothiazole-7-Sulfonate; 7-Benzothiazolesulfonic Acid, 2-(4-((1-(Hydroxymethyl)-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-4-Yl)Azo)Phenyl)-6-Methyl-, Monosodium Salt
• Molecular Formula: C₁₉H₁₆N₅NaO₅S₂
• Molecular Weight: 481.48
• CAS Registry Number: 25983-65-7
• SMILES: C2=C1N=C(SC1=C([S]([O-])(=O)=O)C(=C2)C)C4=CC=C(N=NC3C(=O)N(N=C3C)CO)C=C4.[Na+]
• InChI: 1S/C19H17N5O5S2.Na/c1-10-3-8-14-16(17(10)31(27,28)29)30-18(20-14)12-4-6-13(7-5-12)21-22-15-11(2)23-24(9-25)19(15)26;/h3-8,15,25H,9H2,1-2H3,(H,27,28,29);/q;+1/p-1
• InChIKey: FKCWWNLHFKPKPG-UHFFFAOYSA-M