| SpectraBase Spectrum ID |
2KGNYZZSute |
| Name |
(5E)-1-(4-Chlorophenyl)-5-(1-{[3-(1H-imidazol-1-yl)propyl]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 |
387.109817157 u |
| Formula |
C18H18ClN5O3 |
| InChI |
InChI=1S/C18H18ClN5O3/c1-12(21-7-2-9-23-10-8-20-11-23)15-16(25)22-18(27)24(17(15)26)14-5-3-13(19)4-6-14/h3-6,8,10-11,21H,2,7,9H2,1H3,(H,22,25,27)/b15-12+ |
| InChIKey |
DIVMJJXFAFOHJB-NTCAYCPXSA-N |
| Molecular Weight |
387.827 g/mol |
| SMILES |
N(\C(=C\1C(N(C(NC1=O)=O)C=1C=CC(=CC1)Cl)=O)C)CCCN1C=NC=C1 |
![(5E)-1-(4-chlorophenyl)-5-(1-{[3-(1H-imidazol-1-yl)propyl]amino}ethylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione](/api/spectrum/2KGNYZZSute/structure.png?h=300&w=458 "(5E)-1-(4-chlorophenyl)-5-(1-{[3-(1H-imidazol-1-yl)propyl]amino}ethylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione")
