| SpectraBase Spectrum ID |
B9DDUnkmoB |
| Name |
Methyl 4-(4-bromophenyl)-2-{[(4-fluorophenyl)acetyl]amino}-3-thiophenecarboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
446.994005681 u |
| Formula |
C20H15BrFNO3S |
| InChI |
InChI=1S/C20H15BrFNO3S/c1-26-20(25)18-16(13-4-6-14(21)7-5-13)11-27-19(18)23-17(24)10-12-2-8-15(22)9-3-12/h2-9,11H,10H2,1H3,(H,23,24) |
| InChIKey |
BGRZRYHLVZSAEM-UHFFFAOYSA-N |
| Molecular Weight |
448.306 g/mol |
| SMILES |
N(C1=C(C(=CS1)C=1C=CC(=CC1)Br)C(=O)OC)C(=O)CC=1C=CC(=CC1)F |
![Methyl 4-(4-bromophenyl)-2-{[(4-fluorophenyl)acetyl]amino}-3-thiophenecarboxylate](/api/spectrum/B9DDUnkmoB/structure.png?h=300&w=458 "Methyl 4-(4-bromophenyl)-2-{[(4-fluorophenyl)acetyl]amino}-3-thiophenecarboxylate")
