Disodium 5-{[5-chloro-6-methyl-2-(methylsulfonyl)-4-pyrimidinyl]amino}-4-hydroxy-3-(phenyldiazenyl)-2,7-naphthalenedisulfonate
[CAS# 72894-30-5]

Identification

• Name: Disodium 5-{[5-chloro-6-methyl-2-(methylsulfonyl)-4-pyrimidinyl]amino}-4-hydroxy-3-(phenyldiazenyl)-2,7-naphthalenedisulfonate
• Synonyms: 2,7-Naphthalenedisulfonic acid, 5-[[5-chloro-6-methyl-2-(methylsulfonyl)-4-pyrimidinyl]amino]-4-hydroxy-3-(phenylazo)-, disodium salt
• Molecular Formula: C₂₂H₁₆ClN₅Na₂O₉S₃
• Molecular Weight: 672.02
• CAS Registry Number: 72894-30-5
• SMILES: Cc1c(c(nc(n1)S(=O)(=O)C)Nc2cc(cc3c2c(c(c(c3)S(=O)(=O)[O-])N=Nc4ccccc4)O)S(=O)(=O)[O-])Cl.[Na+].[Na+]
• InChI: 1S/C22H18ClN5O9S3.2Na/c1-11-18(23)21(26-22(24-11)38(2,30)31)25-15-10-14(39(32,33)34)8-12-9-16(40(35,36)37)19(20(29)17(12)15)28-27-13-6-4-3-5-7-13;;/h3-10,29H,1-2H3,(H,24,25,26)(H,32,33,34)(H,35,36,37);;/q;2*+1/p-2
• InChIKey: BNXDCNPDQPCJCL-UHFFFAOYSA-L