Disodium 5-[[4-(Bis(2-Hydroxyethyl)Amino)-6-[(3-Sulfonatophenyl)Amino] -1,3,5-Triazin-2-Yl]Amino]-2-[(E)-2-[4-[[4-(Bis(2-Hydroxyethyl)Amino)- 6-[(3-Sulfonatophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonato-Phenyl]Ethenyl]Benzenesulfonate
[CAS# 66813-34-1]

Identification

• Name: Disodium 5-[[4-(Bis(2-Hydroxyethyl)Amino)-6-[(3-Sulfonatophenyl)Amino] -1,3,5-Triazin-2-Yl]Amino]-2-[(E)-2-[4-[[4-(Bis(2-Hydroxyethyl)Amino)- 6-[(3-Sulfonatophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonato-Phenyl]Ethenyl]Benzenesulfonate
• Synonyms: Disodium 5-[[4-(Bis(2-Hydroxyethyl)Amino)-6-[(3-Sulfonatophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-2-[(E)-2-[4-[[4-(Bis(2-Hydroxyethyl)Amino)-6-[(3-Sulfonatophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonato-Phenyl]Vinyl]Benzenesulfonate; Disodium 5-[[4-(Bis(2-Hydroxyethyl)Amino)-6-[(3-Sulfonatophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-2-[(E)-2-[4-[[4-(Bis(2-Hydroxyethyl)Amino)-6-[(3-Sulfonatophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonatophenyl]Vinyl]Benzenesulfonate; Disodium 5-[[4-(Bis(2-Hydroxyethyl)Amino)-6-[(3-Sulfonatophenyl)Amino]-S-Triazin-2-Yl]Amino]-2-[(E)-2-[4-[[4-(Bis(2-Hydroxyethyl)Amino)-6-[(3-Sulfonatophenyl)Amino]-S-Triazin-2-Yl]Amino]-2-Sulfonato-Phenyl]Vinyl]Benzenesulfonate
• Molecular Formula: C₄₀H₄₀N₁₂Na₂O₁₆S₄
• Molecular Weight: 1119.05
• CAS Registry Number: 66813-34-1
• SMILES: C1=C([S]([O-])(=O)=O)C(=CC=C1NC2=NC(=NC(=N2)NC3=CC=CC(=C3)[S]([O-])(=O)=O)N(CCO)CCO)\C=C\C6=CC=C(NC4=NC(=NC(=N4)NC5=CC=CC(=C5)[S]([O-])(=O)=O)N(CCO)CCO)C=C6[S]([O-])(=O)=O.[Na+].[Na+]
• InChI: 1S/C40H44N12O16S4.2Na/c53-17-13-51(14-18-54)39-47-35(41-27-3-1-5-31(21-27)69(57,58)59)45-37(49-39)43-29-11-9-25(33(23-29)71(63,64)65)7-8-26-10-12-30(24-34(26)72(66,67)68)44-38-46-36(48-40(50-38)52(15-19-55)16-20-56)42-28-4-2-6-32(22-28)70(60,61)62;;/h1-12,21-24,53-56H,13-20H2,(H,57,58,59)(H,60,61,62)(H,63,64,65)(H,66,67,68)(H2,41,43,45,47,49)(H2,42,44,46,48,50);;/q;2*+1/p-4/b8-7+
• InChIKey: LCBNRTVDYLQISA-MIIBGCIDSA-J