| SpectraBase Spectrum ID |
Kftw2lE4P86 |
| Name |
1-[(3-Chloro-1-benzothien-2-yl)carbonyl]-4-[(2E)-3-phenyl-2-propenyl]piperazine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.106312177 u |
| Formula |
C22H21ClN2OS |
| InChI |
InChI=1S/C22H21ClN2OS/c23-20-18-10-4-5-11-19(18)27-21(20)22(26)25-15-13-24(14-16-25)12-6-9-17-7-2-1-3-8-17/h1-11H,12-16H2/b9-6+ |
| InChIKey |
LEVUCLUGMBGBKJ-RMKNXTFCSA-N |
| Molecular Weight |
396.936 g/mol |
| SMILES |
C=1(SC=2C=CC=CC2C1Cl)C(N1CCN(CC1)C\C=C\C1=CC=CC=C1)=O |
![1-[(3-chloro-1-benzothien-2-yl)carbonyl]-4-[(2E)-3-phenyl-2-propenyl]piperazine](/api/spectrum/Kftw2lE4P86/structure.png?h=300&w=458 "1-[(3-chloro-1-benzothien-2-yl)carbonyl]-4-[(2E)-3-phenyl-2-propenyl]piperazine")
