| SpectraBase Spectrum ID |
71KlCWfK909 |
| Name |
4-Bromobenzaldehyde [(2Z)-5-butyl-3-(4-fluorobenzyl)-4-oxo-1,3-thiazolidin-2-ylidene]hydrazone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
461.057274644 u |
| Formula |
C21H21BrFN3OS |
| InChI |
InChI=1S/C21H21BrFN3OS/c1-2-3-4-19-20(27)26(14-16-7-11-18(23)12-8-16)21(28-19)25-24-13-15-5-9-17(22)10-6-15/h5-13,19H,2-4,14H2,1H3/b24-13+,25-21- |
| InChIKey |
NIHGNDBXBLCWFJ-FZYNJZOTSA-N |
| Molecular Weight |
462.381 g/mol |
| SMILES |
CCCCC1C(N(\C(S1)=N\N=C\C1=CC=C(C=C1)Br)CC1=CC=C(C=C1)F)=O |
![4-bromobenzaldehyde [(2Z)-5-butyl-3-(4-fluorobenzyl)-4-oxo-1,3-thiazolidin-2-ylidene]hydrazone](/api/spectrum/71KlCWfK909/structure.png?h=300&w=458 "4-bromobenzaldehyde [(2Z)-5-butyl-3-(4-fluorobenzyl)-4-oxo-1,3-thiazolidin-2-ylidene]hydrazone")
