| SpectraBase Spectrum ID |
2layBHAtUvd |
| Name |
1-Piperazinepropanamide, 4-[(4-chlorophenyl)sulfonyl]-N-(4-fluorophenyl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
425.097618582 u |
| Formula |
C19H21ClFN3O3S |
| InChI |
InChI=1S/C19H21ClFN3O3S/c20-15-1-7-18(8-2-15)28(26,27)24-13-11-23(12-14-24)10-9-19(25)22-17-5-3-16(21)4-6-17/h1-8H,9-14H2,(H,22,25) |
| InChIKey |
YQJMIOGLBAYDFL-UHFFFAOYSA-N |
| Molecular Weight |
425.906 g/mol |
| SMILES |
N(C(CCN1CCN(S(C=2C=CC(=CC2)Cl)(=O)=O)CC1)=O)C1=CC=C(C=C1)F |
![1-piperazinepropanamide, 4-[(4-chlorophenyl)sulfonyl]-N-(4-fluorophenyl)-](/api/spectrum/2layBHAtUvd/structure.png?h=300&w=458 "1-piperazinepropanamide, 4-[(4-chlorophenyl)sulfonyl]-N-(4-fluorophenyl)-")
