| SpectraBase Spectrum ID |
1OF4PisAjdV |
| Name |
(5E)-1-Butyl-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
333.148869676 u |
| Formula |
C17H20FN3O3 |
| InChI |
InChI=1S/C17H20FN3O3/c1-3-4-9-21-16(23)14(15(22)20-17(21)24)11(2)19-10-12-5-7-13(18)8-6-12/h5-8,19H,3-4,9-10H2,1-2H3,(H,20,22,24)/b14-11+ |
| InChIKey |
KGGHRQXGPHAONW-SDNWHVSQSA-N |
| Molecular Weight |
333.363 g/mol |
| SMILES |
N(\C(=C\1C(N(C(NC1=O)=O)CCCC)=O)C)CC=1C=CC(=CC1)F |
![(5E)-1-butyl-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione](/api/spectrum/1OF4PisAjdV/structure.png?h=300&w=458 "(5E)-1-butyl-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione")
