Disodium 5-({4-anilino-6-[2-(2-hydroxyethoxy)ethoxy]-1,3,5-triazin-2-yl}amino)-2-[(E)-2-(4-{[4-anilino-6-(2-hydroxypropoxy)-1,3,5-triazin-2-yl]amino}-2-sulfonatophenyl)vinyl]benzenesulfonate
[CAS# 68025-20-7]

Identification

• Name: Disodium 5-({4-anilino-6-[2-(2-hydroxyethoxy)ethoxy]-1,3,5-triazin-2-yl}amino)-2-[(E)-2-(4-{[4-anilino-6-(2-hydroxypropoxy)-1,3,5-triazin-2-yl]amino}-2-sulfonatophenyl)vinyl]benzenesulfonate
• Synonyms: disodium 5-[[6-anilino-4-[2-(2-hydroxyethoxy)ethoxy]-1,3,5-triazin-2-yl]amino]-2-[2-[4-[[6-anilino-4-(2-hydroxypropoxy)-1,3,5-triazin-2-yl]amino]-2-sulphonatophenyl]vinyl]benzenesulphonate
• Molecular Formula: C₃₉H₃₈N₁₀Na₂O₁₁S₂
• Molecular Weight: 932.89
• CAS Registry Number: 68025-20-7
• EINECS: 268-180-5
• SMILES: [Na+].[Na+].CC(O)COc2nc(Nc1ccccc1)nc(n2)Nc6ccc(/C=C/c3ccc(cc3S([O-])(=O)=O)Nc4nc(nc(OCCOCCO)n4)Nc5ccccc5)c(c6)S([O-])(=O)=O
• InChI: 1S/C39H40N10O11S2.2Na/c1-25(51)24-60-39-48-35(41-29-10-6-3-7-11-29)45-37(49-39)43-31-17-15-27(33(23-31)62(55,56)57)13-12-26-14-16-30(22-32(26)61(52,53)54)42-36-44-34(40-28-8-4-2-5-9-28)46-38(47-36)59-21-20-58-19-18-50;;/h2-17,22-23,25,50-51H,18-21,24H2,1H3,(H,52,53,54)(H,55,56,57)(H2,40,42,44,46,47)(H2,41,43,45,48,49);;/q;2*+1/p-2/b13-12+
• InChIKey: MPXKRGINDHTNJZ-HPAIREQNSA-L