| SpectraBase Spectrum ID |
IkrFAgkYAtw |
| Name |
Urea, N-(3,4-dichlorobenzoyl)-N'-[4-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
456.036765562 u |
| Formula |
C19H13Cl2F3N4O2 |
| InChI |
InChI=1S/C19H13Cl2F3N4O2/c1-10-8-16(19(22,23)24)28(27-10)13-5-3-12(4-6-13)25-18(30)26-17(29)11-2-7-14(20)15(21)9-11/h2-9H,1H3,(H2,25,26,29,30) |
| InChIKey |
SRJIKVGNEJSKKS-UHFFFAOYSA-N |
| Molecular Weight |
457.240 g/mol |
| SMILES |
C=1(C=CC(=C(C1)Cl)Cl)C(NC(NC1=CC=C(N2C(C(F)(F)F)=CC(=N2)C)C=C1)=O)=O |
![Urea, N-(3,4-dichlorobenzoyl)-N'-[4-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl]-](/api/spectrum/IkrFAgkYAtw/structure.png?h=300&w=458 "Urea, N-(3,4-dichlorobenzoyl)-N'-[4-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl]-")
