SpectraBase Spectrum ID |
5vKGqUfbZ58 |
Name |
Acetamide, N-[4-[[4-(3-chlorobenzoyl)-1-piperazinyl]sulfonyl]phenyl]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
421.086305006 u |
Formula |
C19H20ClN3O4S |
InChI |
InChI=1S/C19H20ClN3O4S/c1-14(24)21-17-5-7-18(8-6-17)28(26,27)23-11-9-22(10-12-23)19(25)15-3-2-4-16(20)13-15/h2-8,13H,9-12H2,1H3,(H,21,24) |
InChIKey |
INHULIMALPKFTB-UHFFFAOYSA-N |
Molecular Weight |
421.899 g/mol |
SMILES |
N(C(=O)C)C1=CC=C(S(N2CCN(C(C=3C=C(Cl)C=CC3)=O)CC2)(=O)=O)C=C1 |