SpectraBase Spectrum ID |
K40O9rgu4dw |
Name |
(5E)-5-{[5-(4-Methylphenyl)-2-furyl]methylene}-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1,3-thiazol-4(5H)-one |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
497.138482621 u |
Formula |
C26H22F3N3O2S |
InChI |
InChI=1S/C26H22F3N3O2S/c1-17-5-7-18(8-6-17)22-10-9-21(34-22)16-23-24(33)30-25(35-23)32-13-11-31(12-14-32)20-4-2-3-19(15-20)26(27,28)29/h2-10,15-16H,11-14H2,1H3/b23-16+ |
InChIKey |
DPWUOIYKZRJREM-XQNSMLJCSA-N |
Molecular Weight |
497.536 g/mol |
SMILES |
CC=1C=CC(C=2OC(\C=C/3C(N=C(S3)N3CCN(CC3)C3=CC(C(F)(F)F)=CC=C3)=O)=CC2)=CC1 |