| SpectraBase Spectrum ID |
CNmVS5XFBWq |
| Name |
(5R)-5-Benzylidene-2-[3,5-di(4-fluorophenyl)-4,5-dihydropyrazol-1-yl]thiazol-4-one |
| Appearance |
Yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H17F2N3OS |
| InChI |
InChI=1S/C25H17F2N3OS/c26-19-10-6-17(7-11-19)21-15-22(18-8-12-20(27)13-9-18)30(29-21)25-28-24(31)23(32-25)14-16-4-2-1-3-5-16/h1-14,22H,15H2/t22-/m1/s1 |
| InChIKey |
VVUPWESJRUMBPY-JOCHJYFZSA-N |
| Instrument Name |
Shimadzu GCMS-QP 1000EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2794 |
| Molecular Weight |
445.488 g/mol |
| SMILES |
c1(ccccc1)C=C1C(N=C(S1)N1N=C(C[C@@]1(c1ccc(F)cc1)[H])c1ccc(cc1)F)=O |
| SPLASH |
splash10-001i-2900000000-88d7800e4a45bc12c6f7 |
| Source of Spectrum |
Y-54-1979-7b |
| Wiley ID |
1878396 |
![(5R)-5-Benzylidene-2-[3,5-di(4-fluorophenyl)-4,5-dihydropyrazol-1-yl]thiazol-4-one](/api/spectrum/CNmVS5XFBWq/structure.png?h=300&w=458 "(5R)-5-Benzylidene-2-[3,5-di(4-fluorophenyl)-4,5-dihydropyrazol-1-yl]thiazol-4-one")
