| SpectraBase Spectrum ID |
CmFSdwyDrrF |
| Name |
(5E)-2-[4-(3-Chloro-4-methylphenyl)-1-piperazinyl]-5-{[5-(2,4-dichlorophenyl)-2-furyl]methylene}-1,3-thiazol-4(5H)-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
531.034181168 u |
| Formula |
C25H20Cl3N3O2S |
| InChI |
InChI=1S/C25H20Cl3N3O2S/c1-15-2-4-17(13-20(15)27)30-8-10-31(11-9-30)25-29-24(32)23(34-25)14-18-5-7-22(33-18)19-6-3-16(26)12-21(19)28/h2-7,12-14H,8-11H2,1H3/b23-14+ |
| InChIKey |
ZKHHNXVCYWQNAN-OEAKJJBVSA-N |
| Molecular Weight |
532.873 g/mol |
| SMILES |
CC=1C=CC(N2CCN(C3=NC(\C(=C/C=4OC(C=5C(=CC(=CC5)Cl)Cl)=CC4)S3)=O)CC2)=CC1Cl |