Sodium 2-{4-[(1-anilino-1,3-dioxo-2-butanyl)diazenyl]phenyl}-6-methyl-2,3-dihydro-1,3-benzothiazole-2-sulfonate
[CAS# 94022-29-4]

Identification

• Name: Sodium 2-{4-[(1-anilino-1,3-dioxo-2-butanyl)diazenyl]phenyl}-6-methyl-2,3-dihydro-1,3-benzothiazole-2-sulfonate
• Synonyms: sodium 6-methyl-2-[4-[[2-oxo-1-[(phenylamino)carbonyl]propyl]azo]phenyl]benzothiazolesulphonate
• Molecular Formula: C₂₄H₂₁N₄NaO₅S₂
• Molecular Weight: 532.57
• CAS Registry Number: 94022-29-4
• EINECS: 301-525-0
• SMILES: [Na+].CC(=O)C(N=Nc1ccc(cc1)C2(Nc3ccc(C)cc3S2)S([O-])(=O)=O)C(=O)Nc4ccccc4
• InChI: 1S/C24H22N4O5S2.Na/c1-15-8-13-20-21(14-15)34-24(26-20,35(31,32)33)17-9-11-19(12-10-17)27-28-22(16(2)29)23(30)25-18-6-4-3-5-7-18;/h3-14,22,26H,1-2H3,(H,25,30)(H,31,32,33);/q;+1/p-1
• InChIKey: STQVRYQIEOEIRM-UHFFFAOYSA-M