| SpectraBase Spectrum ID |
IUULgSgZN2T |
| Name |
1-Piperazineacetamide, 4-[(5-chloro-2-methoxyphenyl)sulfonyl]-N-(2,4-difluorophenyl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
459.083111332 u |
| Formula |
C19H20ClF2N3O4S |
| InChI |
InChI=1S/C19H20ClF2N3O4S/c1-29-17-5-2-13(20)10-18(17)30(27,28)25-8-6-24(7-9-25)12-19(26)23-16-4-3-14(21)11-15(16)22/h2-5,10-11H,6-9,12H2,1H3,(H,23,26) |
| InChIKey |
AXMHHFQCXLGTCE-UHFFFAOYSA-N |
| Molecular Weight |
459.896 g/mol |
| SMILES |
N(C(CN1CCN(S(C=2C=C(Cl)C=CC2OC)(=O)=O)CC1)=O)C1=C(C=C(C=C1)F)F |