2-[4-[(5-Oxo-7-Propyl-1H-[1,2,4]Triazolo[1,5-a]Pyrimidin-6-Yl)Methyl]Phenyl]Benzoic Acid
[CAS# 168152-97-4]

Identification

• Name: 2-[4-[(5-Oxo-7-Propyl-1H-[1,2,4]Triazolo[1,5-a]Pyrimidin-6-Yl)Methyl]Phenyl]Benzoic Acid
• Synonyms: 2-[4-[(5-Keto-7-Propyl-1H-[1,2,4]Triazolo[1,5-A]Pyrimidin-6-Yl)Methyl]Phenyl]Benzoic Acid; (1,1'-Biphenyl)-2-Carboxylic Acid, 4'-((1,5-Dihydro-5-Oxo-7-Propyl-1,2,4-Triazolo(1,5-A)Pyrimidin-6-Yl)Methyl)-
• Molecular Formula: C₂₂H₂₀N₄O₃
• Molecular Weight: 388.43
• CAS Registry Number: 168152-97-4
• SMILES: C1=C(C(=CC=C1)C2=CC=C(C=C2)CC3=C(N4C(=NC3=O)N=CN4)CCC)C(=O)O
• InChI: 1S/C22H20N4O3/c1-2-5-19-18(20(27)25-22-23-13-24-26(19)22)12-14-8-10-15(11-9-14)16-6-3-4-7-17(16)21(28)29/h3-4,6-11,13H,2,5,12H2,1H3,(H,28,29)(H,23,24,25,27)
• InChIKey: OREOAKRJKYNIJK-UHFFFAOYSA-N