| SpectraBase Spectrum ID |
DDu6GCIIkYM |
| Name |
Propyl 2-{[(2-chloro-3-pyridinyl)carbonyl]amino}-4-(4-fluorophenyl)-3-thiophenecarboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
418.055419417 u |
| Formula |
C20H16ClFN2O3S |
| InChI |
InChI=1S/C20H16ClFN2O3S/c1-2-10-27-20(26)16-15(12-5-7-13(22)8-6-12)11-28-19(16)24-18(25)14-4-3-9-23-17(14)21/h3-9,11H,2,10H2,1H3,(H,24,25) |
| InChIKey |
JNRPICHTWXTSDM-UHFFFAOYSA-N |
| Molecular Weight |
418.870 g/mol |
| SMILES |
N(C1=C(C(=CS1)C=1C=CC(=CC1)F)C(=O)OCCC)C(C=1C(=NC=CC1)Cl)=O |
![Propyl 2-{[(2-chloro-3-pyridinyl)carbonyl]amino}-4-(4-fluorophenyl)-3-thiophenecarboxylate](/api/spectrum/DDu6GCIIkYM/structure.png?h=300&w=458 "Propyl 2-{[(2-chloro-3-pyridinyl)carbonyl]amino}-4-(4-fluorophenyl)-3-thiophenecarboxylate")
