| SpectraBase Spectrum ID |
JqnCOnw6I8 |
| Name |
5-Methyl-1,3-diphenyl-1H-pyrazole-4-carboxylic acid (2-isopropyl-6-methyl-phenyl)-amide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
409.215412500 u |
| Formula |
C27H27N3O |
| InChI |
InChI=1S/C27H27N3O/c1-18(2)23-17-11-12-19(3)25(23)28-27(31)24-20(4)30(22-15-9-6-10-16-22)29-26(24)21-13-7-5-8-14-21/h5-18H,1-4H3,(H,28,31) |
| InChIKey |
YKPLMGYVHMUEOT-UHFFFAOYSA-N |
| Molecular Weight |
409.533 g/mol |
| SMILES |
C=1C=CC(=CC1)C1=NN(C(=C1C(NC1=C(C=CC=C1C(C)C)C)=O)C)C1=CC=CC=C1 |
