![1-{[5-(p-chlorophenyl)-3-(methylthio)-4-isoxazolyl]carbonyl}-3-(2,4-difluorophenyl)urea](/api/spectrum/5aM8C9J1AMn/structure.png?h=300&w=458 "1-{[5-(p-chlorophenyl)-3-(methylthio)-4-isoxazolyl]carbonyl}-3-(2,4-difluorophenyl)urea")
| SpectraBase Compound ID | 4ZpIsvn7Hyx |
|---|---|
| InChI | InChI=1S/C18H12ClF2N3O3S/c1-28-17-14(15(27-24-17)9-2-4-10(19)5-3-9)16(25)23-18(26)22-13-7-6-11(20)8-12(13)21/h2-8H,1H3,(H2,22,23,25,26) |
| InChIKey | MHKLOJDGSNOUQN-UHFFFAOYSA-N |
| Mol Weight | 423.82 g/mol |
| Molecular Formula | C18H12ClF2N3O3S |
| Exact Mass | 423.025596 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5aM8C9J1AMn |
|---|---|
| Name | 1-{[5-(p-chlorophenyl)-3-(methylthio)-4-isoxazolyl]carbonyl}-3-(2,4-difluorophenyl)urea |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H12ClF2N3O3S |
| InChI | InChI=1S/C18H12ClF2N3O3S/c1-28-17-14(15(27-24-17)9-2-4-10(19)5-3-9)16(25)23-18(26)22-13-7-6-11(20)8-12(13)21/h2-8H,1H3,(H2,22,23,25,26) |
| InChIKey | MHKLOJDGSNOUQN-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56433M |
| Solvent | Polysol |