Tetrasodium 4,4'-Bis[[4-(2-Benzothiazolyl-6-Methyl)Sulphonatophenyl]Azoxy]Stilbene-2,2'-Disulphonate
[CAS# 63346-49-6]

Identification

• Name: Tetrasodium 4,4'-Bis[[4-(2-Benzothiazolyl-6-Methyl)Sulphonatophenyl]Azoxy]Stilbene-2,2'-Disulphonate
• Synonyms: Tetrasodium 5-(1,3-Benzothiazol-2-Yl)-2-[[[4-[(E)-2-[4-[[4-(1,3-Benzothiazol-2-Yl)-2-Methyl-6-Sulfonato-Phenyl]Imino-Oxido-Azaniumyl]-2-Sulfonato-Phenyl]Vinyl]-3-Sulfonato-Phenyl]-Oxido-Azaniumylidene]Amino]-3-Methyl-Benzenesulfonate; Tetrasodium 5-(1,3-Benzothiazol-2-Yl)-2-[[[4-[(E)-2-[4-[[4-(1,3-Benzothiazol-2-Yl)-2-Methyl-6-Sulfonatophenyl]Imino-Oxidoazaniumyl]-2-Sulfonatophenyl]Vinyl]-3-Sulfonatophenyl]-Oxidoazaniumylidene]Amino]-3-Methylbenzenesulfonate; Tetrasodium 5-(1,3-Benzothiazol-2-Yl)-2-[[[4-[(E)-2-[4-[[4-(1,3-Benzothiazol-2-Yl)-2-Methyl-6-Sulfonato-Phenyl]Imino-Oxido-Azaniumyl]-2-Sulfonato-Phenyl]Ethenyl]-3-Sulfonato-Phenyl]-Oxido-Azaniumylidene]Amino]-3-Methyl-Benzenesulfonate
• Molecular Formula: C₄₂H₂₆N₆Na₄O₁₄S₆
• Molecular Weight: 1123.02
• CAS Registry Number: 63346-49-6
• EINECS: 264-107-6
• SMILES: C1=C([S]([O-])(=O)=O)C(=C(C=C1C3=NC2=CC=CC=C2S3)C)[N-][N+](=O)C4=CC=C(C(=C4)[S]([O-])(=O)=O)\C=C\C8=CC=C([N+](=O)[N-]C7=C(C=C(C6=NC5=CC=CC=C5S6)C=C7[S]([O-])(=O)=O)C)C=C8[S]([O-])(=O)=O.[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C42H30N6O14S6.4Na/c1-23-17-27(41-43-31-7-3-5-9-33(31)63-41)19-37(67(57,58)59)39(23)45-47(49)29-15-13-25(35(21-29)65(51,52)53)11-12-26-14-16-30(22-36(26)66(54,55)56)48(50)46-40-24(2)18-28(20-38(40)68(60,61)62)42-44-32-8-4-6-10-34(32)64-42;;;;/h3-22H,1-2H3,(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62);;;;/q;4*+1/p-4/b12-11+,47-45?,48-46?
• InChIKey: FXHKTENYHCOKAE-FYMABUFDSA-J