| SpectraBase Spectrum ID |
4Wj2DRUWrjQ |
| Name |
4-oxo-4-[4-(2-Pyridinyl)-1-piperazinyl]-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
414.108579472 u |
| Formula |
C16H17F3N6O2S |
| InChI |
InChI=1S/C16H17F3N6O2S/c17-16(18,19)14-22-23-15(28-14)21-12(26)4-5-13(27)25-9-7-24(8-10-25)11-3-1-2-6-20-11/h1-3,6H,4-5,7-10H2,(H,21,23,26) |
| InChIKey |
GJGGJRVJRKQQDU-UHFFFAOYSA-N |
| Molecular Weight |
414.407 g/mol |
| SMILES |
N(C=1SC(=NN1)C(F)(F)F)C(=O)CCC(N1CCN(CC1)C1=NC=CC=C1)=O |
![4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide](/api/spectrum/4Wj2DRUWrjQ/structure.png?h=300&w=458 "4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide")
