| SpectraBase Spectrum ID |
htQQ4yGtqs |
| Name |
1-{alpha-[(p-Chlorophenyl)thio]-p-toluoyl}-3-(alpha,alpha,alpha-trifluoro-m-tolyl)urea |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
464.057311124 u |
| Formula |
C22H16ClF3N2O2S |
| InChI |
InChI=1S/C22H16ClF3N2O2S/c23-17-8-10-19(11-9-17)31-13-14-4-6-15(7-5-14)20(29)28-21(30)27-18-3-1-2-16(12-18)22(24,25)26/h1-12H,13H2,(H2,27,28,29,30) |
| InChIKey |
ZUYCLDUOSKEXBJ-UHFFFAOYSA-N |
| Molecular Weight |
464.890 g/mol |
| SMILES |
N(C1=CC=CC(=C1)C(F)(F)F)C(NC(C=1C=CC(=CC1)CSC=1C=CC(=CC1)Cl)=O)=O |
![1-{alpha-[(p-Chlorophenyl)thio]-p-toluoyl}-3-(alpha,alpha,alpha-trifluoro-m-tolyl)urea](/api/spectrum/htQQ4yGtqs/structure.png?h=300&w=458 "1-{alpha-[(p-Chlorophenyl)thio]-p-toluoyl}-3-(alpha,alpha,alpha-trifluoro-m-tolyl)urea")
