Dilithium Disodium (3Z)-5-Amino-3-[[5-[(5-Chloro-2,6-Difluoropyrimidin-4-Yl)Amino]-2-Sulfonatophenyl]Hydrazinylidene]-4-Oxo-6-[4-(2-Sulfonatooxyethylsulfonyl)Phenyl]Diazenylnaphthalene-2,7-Disulfonate
[CAS# 108624-00-6]

Identification

• Name: Dilithium Disodium (3Z)-5-Amino-3-[[5-[(5-Chloro-2,6-Difluoropyrimidin-4-Yl)Amino]-2-Sulfonatophenyl]Hydrazinylidene]-4-Oxo-6-[4-(2-Sulfonatooxyethylsulfonyl)Phenyl]Diazenylnaphthalene-2,7-Disulfonate
• Synonyms: Dilithium Disodium (3Z)-5-Amino-3-[[5-[(5-Chloro-2,6-Difluoro-Pyrimidin-4-Yl)Amino]-2-Sulfonato-Phenyl]Hydrazono]-4-Oxo-6-[4-(2-Sulfonatooxyethylsulfonyl)Phenyl]Azo-Naphthalene-2,7-Disulfonate; Dilithium Disodium (3Z)-5-Amino-3-[[5-[(5-Chloro-2,6-Difluoro-4-Pyrimidinyl)Amino]-2-Sulfonatophenyl]Hydrazono]-4-Oxo-6-[4-(2-Sulfonatooxyethylsulfonyl)Phenyl]Azonaphthalene-2,7-Disulfonate; Dilithium Disodium (3Z)-5-Amino-3-[[5-[(5-Chloro-2,6-Difluoro-Pyrimidin-4-Yl)Amino]-2-Sulfonato-Phenyl]Hydrazono]-4-Keto-6-[4-(2-Sulfatoethylsulfonyl)Phenyl]Azo-Naphthalene-2,7-Disulfonate
• Molecular Formula: C₂₈H₁₇ClF₂Li₂N₈Na₂O₁₆S₅
• Molecular Weight: 1015.10
• CAS Registry Number: 108624-00-6 (132174-48-2)
• SMILES: [Li+].C1=C5C(=C(N)C(=C1[S]([O-])(=O)=O)N=NC2=CC=C([S](=O)(=O)CCO[S]([O-])(=O)=O)C=C2)C(=O)C(=N/NC3=C([S]([O-])(=O)=O)C=CC(=C3)NC4=C(Cl)C(=NC(=N4)F)F)/C(=C5)[S]([O-])(=O)=O.[Na+].[Na+].[Li+]
• InChI: 1S/C28H21ClF2N8O16S5.2Li.2Na/c29-21-26(30)34-28(31)35-27(21)33-14-3-6-17(57(43,44)45)16(11-14)37-39-24-19(59(49,50)51)10-12-9-18(58(46,47)48)23(22(32)20(12)25(24)40)38-36-13-1-4-15(5-2-13)56(41,42)8-7-55-60(52,53)54;;;;/h1-6,9-11,37H,7-8,32H2,(H,33,34,35)(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;;;/q;4*+1/p-4/b38-36?,39-24+
• InChIKey: OBOXNUGISJYBKV-ZKLNYUHUSA-J