Trisodium (3E)-5-[[4-Methylamino-6-[[3-[(2,5,6-Trichloropyrimidin-4-Yl)Amino]Phenyl]Amino]-1,3,5-Triazin-2-Yl]Amino]-4-Oxo-3-[(2-Sulfonatophenyl)Hydrazinylidene]Naphthalene-2,7-Disulfonate
[CAS# 72139-15-2]

Identification

• Name: Trisodium (3E)-5-[[4-Methylamino-6-[[3-[(2,5,6-Trichloropyrimidin-4-Yl)Amino]Phenyl]Amino]-1,3,5-Triazin-2-Yl]Amino]-4-Oxo-3-[(2-Sulfonatophenyl)Hydrazinylidene]Naphthalene-2,7-Disulfonate
• Synonyms: Trisodium (3E)-5-[[4-Methylamino-6-[[3-[(2,5,6-Trichloropyrimidin-4-Yl)Amino]Phenyl]Amino]-1,3,5-Triazin-2-Yl]Amino]-4-Oxo-3-[(2-Sulfonatophenyl)Hydrazono]Naphthalene-2,7-Disulfonate; Trisodium (3E)-5-[[4-Methylamino-6-[[3-[(2,5,6-Trichloro-4-Pyrimidinyl)Amino]Phenyl]Amino]-1,3,5-Triazin-2-Yl]Amino]-4-Oxo-3-[(2-Sulfonatophenyl)Hydrazono]Naphthalene-2,7-Disulfonate; Trisodium (3E)-4-Keto-5-[[4-Methylamino-6-[[3-[(2,5,6-Trichloropyrimidin-4-Yl)Amino]Phenyl]Amino]-S-Triazin-2-Yl]Amino]-3-[(2-Sulfonatophenyl)Hydrazono]Naphthalene-2,7-Disulfonate
• Molecular Formula: C₃₀H₁₉Cl₃N₁₁Na₃O₁₀S₃
• Molecular Weight: 965.06
• CAS Registry Number: 72139-15-2
• EINECS: 276-372-5
• SMILES: C4=C([S]([O-])(=O)=O)C=C(NC1=NC(=NC(=N1)NC2=CC=CC(=C2)NC3=C(Cl)C(=NC(=N3)Cl)Cl)NC)C6=C4C=C([S]([O-])(=O)=O)/C(=N/NC5=CC=CC=C5[S]([O-])(=O)=O)C6=O.[Na+].[Na+].[Na+]
• InChI: 1S/C30H22Cl3N11O10S3.3Na/c1-34-28-40-29(36-15-6-4-5-14(11-15)35-26-22(31)25(32)38-27(33)39-26)42-30(41-28)37-18-12-16(55(46,47)48)9-13-10-20(57(52,53)54)23(24(45)21(13)18)44-43-17-7-2-3-8-19(17)56(49,50)51;;;/h2-12,43H,1H3,(H,35,38,39)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H3,34,36,37,40,41,42);;;/q;3*+1/p-3/b44-23-
• InChIKey: BUSBMHDVDUKLCY-QLZAIFKTSA-K