| SpectraBase Spectrum ID |
9kJshu3Y6Ub |
| Name |
2-[4-(4-Methylphenyl)-6-phenyl-2-pyrimidinyl]-5-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
404.163711279 u |
| Formula |
C26H20N4O |
| InChI |
InChI=1S/C26H20N4O/c1-18-12-14-21(15-13-18)23-16-22(19-8-4-2-5-9-19)27-26(28-23)30-25(31)17-24(29-30)20-10-6-3-7-11-20/h2-17,29H,1H3 |
| InChIKey |
RIWNFUVGNXZONP-UHFFFAOYSA-N |
| Molecular Weight |
404.473 g/mol |
| SMILES |
N1C(=CC(N1C=1N=C(C=2C=CC=CC2)C=C(N1)C1=CC=C(C=C1)C)=O)C1=CC=CC=C1 |
![2-[4-(4-methylphenyl)-6-phenyl-2-pyrimidinyl]-5-phenyl-1,2-dihydro-3H-pyrazol-3-one](/api/spectrum/9kJshu3Y6Ub/structure.png?h=300&w=458 "2-[4-(4-methylphenyl)-6-phenyl-2-pyrimidinyl]-5-phenyl-1,2-dihydro-3H-pyrazol-3-one")
