| SpectraBase Spectrum ID |
7WaFX5A9Wq8 |
| Name |
Piperidine, 1-[[4-[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-4-thiazolyl]phenyl]sulfonyl]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
552.112367744 u |
| Formula |
C27H25FN4O2S3 |
| InChI |
InChI=1S/C27H25FN4O2S3/c28-21-10-6-20(7-11-21)25-17-23(26-5-4-16-35-26)30-32(25)27-29-24(18-36-27)19-8-12-22(13-9-19)37(33,34)31-14-2-1-3-15-31/h4-13,16,18,25H,1-3,14-15,17H2 |
| InChIKey |
ALIHAGCIJOSKTQ-UHFFFAOYSA-N |
| Molecular Weight |
552.701 g/mol |
| SMILES |
C1CCN(S(C2=CC=C(C=3N=C(N4N=C(C=5SC=CC5)CC4C=4C=CC(=CC4)F)SC3)C=C2)(=O)=O)CC1 |
![piperidine, 1-[[4-[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-4-thiazolyl]phenyl]sulfonyl]-](/api/spectrum/7WaFX5A9Wq8/structure.png?h=300&w=458 "piperidine, 1-[[4-[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-4-thiazolyl]phenyl]sulfonyl]-")
