Vaneprim
[CAS# 81523-49-1]

Identification

• Name: Vaneprim
• Synonyms: [[4-Amino-5-[(3,4,5-Trimethoxyphenyl)Methyl]Pyrimidin-2-Yl]Amino]-(3-Ethoxy-4-Hydroxy-Phenyl)Methanesulfonic Acid; [[4-Amino-5-[(3,4,5-Trimethoxyphenyl)Methyl]-2-Pyrimidinyl]Amino]-(3-Ethoxy-4-Hydroxyphenyl)Methanesulfonic Acid; [[4-Amino-5-(3,4,5-Trimethoxybenzyl)Pyrimidin-2-Yl]Amino]-(3-Ethoxy-4-Hydroxy-Phenyl)Methanesulfonic Acid
• Molecular Formula: C₂₃H₂₈N₄O₈S
• Molecular Weight: 520.56
• CAS Registry Number: 81523-49-1
• SMILES: C3=C(C(NC2=NC(=C(CC1=CC(=C(C(=C1)OC)OC)OC)C=N2)N)[S](O)(=O)=O)C=CC(=C3OCC)O
• InChI: 1S/C23H28N4O8S/c1-5-35-17-11-14(6-7-16(17)28)22(36(29,30)31)27-23-25-12-15(21(24)26-23)8-13-9-18(32-2)20(34-4)19(10-13)33-3/h6-7,9-12,22,28H,5,8H2,1-4H3,(H,29,30,31)(H3,24,25,26,27)
• InChIKey: HCHKZQYFQOONNE-UHFFFAOYSA-N

Properties

• Density: 1.415g/cm³ (Cal.)