Sodium 2'-[4-[(4,5-Dihydro-3-Methyl-5-Oxo-1-Phenyl-1H-Pyrazol-4-Yl)Azo]Phenyl]-6-Methyl[2,6'-Bibenzothiazole]-7-Sulphonate
[CAS# 6359-80-4]

Identification

• Name: Sodium 2'-[4-[(4,5-Dihydro-3-Methyl-5-Oxo-1-Phenyl-1H-Pyrazol-4-Yl)Azo]Phenyl]-6-Methyl[2,6'-Bibenzothiazole]-7-Sulphonate
• Synonyms: Sodium 6-Methyl-2-[2-[4-[(3-Methyl-5-Oxo-1-Phenyl-4H-Pyrazol-4-Yl)Azo]Phenyl]-1,3-Benzothiazol-6-Yl]-1,3-Benzothiazole-7-Sulfonate; Sodium 2-[2-[4-[(5-Keto-3-Methyl-1-Phenyl-4H-Pyrazol-4-Yl)Azo]Phenyl]-1,3-Benzothiazol-6-Yl]-6-Methyl-1,3-Benzothiazole-7-Sulfonate
• Molecular Formula: C₃₁H₂₁N₆NaO₄S₃
• Molecular Weight: 660.71
• CAS Registry Number: 6359-80-4
• EINECS: 228-807-5
• SMILES: C2=C1N=C(SC1=C([S]([O-])(=O)=O)C(=C2)C)C4=CC=C3N=C(SC3=C4)C7=CC=C(N=NC5C(=O)N(N=C5C)C6=CC=CC=C6)C=C7.[Na+]
• InChI: 1S/C31H22N6O4S3.Na/c1-17-8-14-24-27(28(17)44(39,40)41)43-30(33-24)20-11-15-23-25(16-20)42-29(32-23)19-9-12-21(13-10-19)34-35-26-18(2)36-37(31(26)38)22-6-4-3-5-7-22;/h3-16,26H,1-2H3,(H,39,40,41);/q;+1/p-1
• InChIKey: CTRCUEJBQJXLOE-UHFFFAOYSA-M