Disodium 4-[[5-Chloro-6-Methyl-2-(Methylsulphonyl)-4-Pyrimidinyl]Amino]-5-Hydroxynaphthalene-1,7-Disulphonate
[CAS# 84145-67-5]

Identification

• Name: Disodium 4-[[5-Chloro-6-Methyl-2-(Methylsulphonyl)-4-Pyrimidinyl]Amino]-5-Hydroxynaphthalene-1,7-Disulphonate
• Synonyms: Disodium 4-[(5-Chloro-6-Methyl-2-Methylsulfonyl-Pyrimidin-4-Yl)Amino]-5-Hydroxy-Naphthalene-1,7-Disulfonate; Disodium 4-[(5-Chloro-6-Methyl-2-Methylsulfonyl-4-Pyrimidinyl)Amino]-5-Hydroxynaphthalene-1,7-Disulfonate; Disodium 4-[(5-Chloro-2-Mesyl-6-Methyl-Pyrimidin-4-Yl)Amino]-5-Hydroxy-Naphthalene-1,7-Disulfonate
• Molecular Formula: C₁₆H₁₂ClN₃Na₂O₉S₃
• Molecular Weight: 567.90
• CAS Registry Number: 84145-67-5
• EINECS: 282-295-8
• SMILES: C1=C([S]([O-])(=O)=O)C=C(O)C2=C1C(=CC=C2NC3=NC(=NC(=C3Cl)C)[S](=O)(=O)C)[S]([O-])(=O)=O.[Na+].[Na+]
• InChI: 1S/C16H14ClN3O9S3.2Na/c1-7-14(17)15(20-16(18-7)30(2,22)23)19-10-3-4-12(32(27,28)29)9-5-8(31(24,25)26)6-11(21)13(9)10;;/h3-6,21H,1-2H3,(H,18,19,20)(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2
• InChIKey: MGGAPASMMHGARS-UHFFFAOYSA-L