| SpectraBase Spectrum ID |
4id9OVslKsy |
| Name |
1-(4-Chlorophenyl)-4-{[4-ethoxy-2-methyl-5-(propan-2-yl)benzene]sulfonyl}piperazine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
436.158741673 u |
| Formula |
C22H29ClN2O3S |
| InChI |
InChI=1S/C22H29ClN2O3S/c1-5-28-21-14-17(4)22(15-20(21)16(2)3)29(26,27)25-12-10-24(11-13-25)19-8-6-18(23)7-9-19/h6-9,14-16H,5,10-13H2,1-4H3 |
| InChIKey |
LSWBMCJTSBLDLW-UHFFFAOYSA-N |
| Molecular Weight |
436.998 g/mol |
| SMILES |
CCOC1=CC(=C(S(N2CCN(CC2)C2=CC=C(C=C2)Cl)(=O)=O)C=C1C(C)C)C |
![1-(4-Chlorophenyl)-4-{[4-ethoxy-2-methyl-5-(propan-2-yl)benzene]sulfonyl}piperazine](/api/spectrum/4id9OVslKsy/structure.png?h=300&w=458 "1-(4-Chlorophenyl)-4-{[4-ethoxy-2-methyl-5-(propan-2-yl)benzene]sulfonyl}piperazine")
