SpectraBase Spectrum ID |
J2YVbvMKIbU |
Name |
5-[4-[[1-(Pyridin-2-yl)piperidin-4-yl]methoxy]phenylmethylene]thiazolidione-2,4-dione |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
395.130362719 u |
Formula |
C21H21N3O3S |
InChI |
InChI=1S/C21H21N3O3S/c25-20-18(28-21(26)23-20)13-15-4-6-17(7-5-15)27-14-16-8-11-24(12-9-16)19-3-1-2-10-22-19/h1-7,10,13,16H,8-9,11-12,14H2,(H,23,25,26)/b18-13- |
InChIKey |
UOWQQPASTHLWMF-AQTBWJFISA-N |
Molecular Weight |
395.477 g/mol |
SMILES |
C1(NC(\C(S1)=C\C1=CC=C(OCC2CCN(CC2)C2=NC=CC=C2)C=C1)=O)=O |