SpectraBase Compound ID | 2rGNMQ0A52o |
---|---|
InChI | InChI=1S/C20H22N4O/c1-14-9-7-8-10-17(14)13-24-16(3)19(15(2)23-24)22-20(25)21-18-11-5-4-6-12-18/h4-12H,13H2,1-3H3,(H2,21,22,25) |
InChIKey | BANARKYEFBYCBI-UHFFFAOYSA-N |
Mol Weight | 334.42 g/mol |
Molecular Formula | C20H22N4O |
Exact Mass | 334.179361 g/mol |
SpectraBase Spectrum ID | C5fkJN05H4C |
---|---|
Name | N-[3,5-Dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]-N'-phenylurea |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 334.179361343 u |
Formula | C20H22N4O |
InChI | InChI=1S/C20H22N4O/c1-14-9-7-8-10-17(14)13-24-16(3)19(15(2)23-24)22-20(25)21-18-11-5-4-6-12-18/h4-12H,13H2,1-3H3,(H2,21,22,25) |
InChIKey | BANARKYEFBYCBI-UHFFFAOYSA-N |
SMILES | N(C(=O)NC1=C(N(N=C1C)CC=1C(C)=CC=CC1)C)C1=CC=CC=C1 |