Tetrasodium 2,2'-{carbonylbis[imino(3-methyl-4,1-phenylene)-2,1-diazenediyl(2-sulfonato-4,1-phenylene)]}bis(6-methyl-1,3-benzothiazole-7-sulfonate)
[CAS# 85099-38-3]

Identification

• Name: Tetrasodium 2,2'-{carbonylbis[imino(3-methyl-4,1-phenylene)-2,1-diazenediyl(2-sulfonato-4,1-phenylene)]}bis(6-methyl-1,3-benzothiazole-7-sulfonate)
• Synonyms: tetrasodium 2,2'-[carbonylbis[imino(2-methyl-p-phenylene)azo(3-sulphonato-p-phenylene)]]bis[6-methylbenzothiazole-7-sulphonate]
• Molecular Formula: C₄₃H₃₀N₈Na₄O₁₃S₆
• Molecular Weight: 1151.09
• CAS Registry Number: 85099-38-3
• EINECS: 285-494-8
• SMILES: [Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)c2c(C)ccc1nc(sc12)c3ccc(cc3S([O-])(=O)=O)N=Nc8ccc(NC(=O)Nc4ccc(cc4C)N=Nc7ccc(c5nc6ccc(C)c(c6s5)S([O-])(=O)=O)c(c7)S([O-])(=O)=O)c(C)c8
• InChI: 1S/C43H34N8O13S6.4Na/c1-21-5-13-33-37(39(21)69(59,60)61)65-41(44-33)29-11-7-27(19-35(29)67(53,54)55)50-48-25-9-15-31(23(3)17-25)46-43(52)47-32-16-10-26(18-24(32)4)49-51-28-8-12-30(36(20-28)68(56,57)58)42-45-34-14-6-22(2)40(38(34)66-42)70(62,63)64;;;;/h5-20H,1-4H3,(H2,46,47,52)(H,53,54,55)(H,56,57,58)(H,59,60,61)(H,62,63,64);;;;/q;4*+1/p-4
• InChIKey: AENZVHRMKJIIRE-UHFFFAOYSA-J