| SpectraBase Spectrum ID |
4p7of57PRjm |
| Name |
(2Z)-3-[5-(4-Bromophenyl)-2-furyl]-2-{[4-(3-methylphenyl)-1-piperazinyl]carbonyl}-2-propenenitrile |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
475.089539958 u |
| Formula |
C25H22BrN3O2 |
| InChI |
InChI=1S/C25H22BrN3O2/c1-18-3-2-4-22(15-18)28-11-13-29(14-12-28)25(30)20(17-27)16-23-9-10-24(31-23)19-5-7-21(26)8-6-19/h2-10,15-16H,11-14H2,1H3/b20-16- |
| InChIKey |
BAVIDEUSVBNXCB-SILNSSARSA-N |
| Molecular Weight |
476.374 g/mol |
| SMILES |
C(\C(=C/C=1OC(C2=CC=C(C=C2)Br)=CC1)C#N)(N1CCN(CC1)C=1C=C(C)C=CC1)=O |
![(2Z)-3-[5-(4-bromophenyl)-2-furyl]-2-{[4-(3-methylphenyl)-1-piperazinyl]carbonyl}-2-propenenitrile](/api/spectrum/4p7of57PRjm/structure.png?h=300&w=458 "(2Z)-3-[5-(4-bromophenyl)-2-furyl]-2-{[4-(3-methylphenyl)-1-piperazinyl]carbonyl}-2-propenenitrile")
