Disodium 5-({4-anilino-6-[(2-hydroxyethyl)(methyl)amino]-1,3,5-triazin-2-yl}amino)-2-{(E)-2-[4-({4-[(2-hydroxyethyl)(methyl)amino]-6-phenyl-1,3,5-triazin-2-yl}amino)-2-sulfonatophenyl]vinyl}benzenesul fonate

SMILES:

[Na+].[Na+].[O-]S(=O)(=O)c3cc(Nc1nc(nc(n1)N(CCO)C)c2ccccc2)ccc3\C=C\c4ccc(cc4S([O-])(=O)=O)Nc5nc(nc(n5)N(C)CCO)Nc6ccccc6 CopyCopied

Std. InChI:

InChI=1S/C38H39N11O8S2.2Na/c1-48(19-21-50)37-43-33(27-9-5-3-6-10-27)42-34(45-37)40-29-17-15-25(31(23-29)58(52,53)54)13-14-26-16-18-30(24-32(26)59(55,56)57)41-36-44-35(39-28-11-7-4-8-12-28)46-38(47-36)49(2)20-22-51;;/h3-18,23-24,50-51H,19-22H2,1-2H3,(H,52,53,54)(H,55,56,57)(H,40,42,43,45)(H2,39,41,44,46,47);;/q;2*+1/p-2/b14-13+;; CopyCopied

Std. InChIKey:

IPXBRSRHEPYVLF-QDBORUFSSA-L CopyCopied

CSID:4939446, http://www.chemspider.com/Chemical-Structure.4939446.html (accessed 05:52, Jun 20, 2013) CopyCopied