| SpectraBase Spectrum ID |
4Vbxxq6CHvB |
| Name |
1-{5-[(4-Bromo-1H-pyrazol-1-yl)methyl]-2-furoyl}-4-(2-furoyl)piperazine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.043318039 u |
| Formula |
C18H17BrN4O4 |
| InChI |
InChI=1S/C18H17BrN4O4/c19-13-10-20-23(11-13)12-14-3-4-16(27-14)18(25)22-7-5-21(6-8-22)17(24)15-2-1-9-26-15/h1-4,9-11H,5-8,12H2 |
| InChIKey |
PBTNPHGQDUQWCC-UHFFFAOYSA-N |
| Molecular Weight |
433.262 g/mol |
| SMILES |
C(N1CCN(CC1)C(C=1OC(CN2N=CC(=C2)Br)=CC1)=O)(C=1OC=CC1)=O |
![1-{5-[(4-bromo-1H-pyrazol-1-yl)methyl]-2-furoyl}-4-(2-furoyl)piperazine](/api/spectrum/4Vbxxq6CHvB/structure.png?h=300&w=458 "1-{5-[(4-bromo-1H-pyrazol-1-yl)methyl]-2-furoyl}-4-(2-furoyl)piperazine")
