3-[(4-Amino-2-Methylpyrimidin-5-Yl)Methyl]-5-(2-Hydroxyethyl)-4-Methylthiazolium Hydrogen Naphthalene-1,5-Disulphonate
[CAS# 573-09-1]

Identification

• Name: 3-[(4-Amino-2-Methylpyrimidin-5-Yl)Methyl]-5-(2-Hydroxyethyl)-4-Methylthiazolium Hydrogen Naphthalene-1,5-Disulphonate
• Synonyms: 2-[3-[(4-Amino-2-Methyl-Pyrimidin-5-Yl)Methyl]-4-Methyl-Thiazol-3-Ium-5-Yl]Ethanol; 5-Sulfonaphthalene-1-Sulfonate; 2-[3-[(4-Amino-2-Methyl-5-Pyrimidinyl)Methyl]-4-Methyl-5-Thiazol-3-Iumyl]Ethanol; 5-Sulfo-1-Naphthalenesulfonate; 2-[3-[(4-Amino-2-Methyl-Pyrimidin-5-Yl)Methyl]-4-Methyl-1,3-Thiazol-3-Ium-5-Yl]Ethanol; 5-Sulfonaphthalene-1-Sulfonate
• Molecular Formula: C₂₂H₂₄N₄O₇S₃
• Molecular Weight: 552.63
• CAS Registry Number: 573-09-1
• EINECS: 209-349-5
• SMILES: C1=CC=C([S](=O)(=O)O)C2=CC=CC(=C12)[S]([O-])(=O)=O.C3=[N+](C(=C(S3)CCO)C)CC4=CN=C(N=C4N)C
• InChI: 1S/C12H17N4OS.C10H8O6S2/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;11-17(12,13)9-5-1-3-7-8(9)4-2-6-10(7)18(14,15)16/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);1-6H,(H,11,12,13)(H,14,15,16)/q+1;/p-1
• InChIKey: STJLLECREIYBCK-UHFFFAOYSA-M