SpectraBase Spectrum ID |
LpeHfgMDKzK |
Name |
Acetamide, N-[4-[[4-[2-(4-methylphenoxy)acetyl]-1-piperazinyl]sulfonyl]phenyl]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
431.151492086 u |
Formula |
C21H25N3O5S |
InChI |
InChI=1S/C21H25N3O5S/c1-16-3-7-19(8-4-16)29-15-21(26)23-11-13-24(14-12-23)30(27,28)20-9-5-18(6-10-20)22-17(2)25/h3-10H,11-15H2,1-2H3,(H,22,25) |
InChIKey |
FLYIQHRWXFBSEE-UHFFFAOYSA-N |
Molecular Weight |
431.507 g/mol |
SMILES |
N(C(=O)C)C=1C=CC(S(N2CCN(CC2)C(COC2=CC=C(C=C2)C)=O)(=O)=O)=CC1 |