![1-[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]-3-[4-(propylsulfonyl)-3-thienyl]urea](/api/spectrum/BA7Xarzlqwm/structure.png?h=300&w=458 "1-[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]-3-[4-(propylsulfonyl)-3-thienyl]urea")
| SpectraBase Compound ID | 91ki6BksTMr |
|---|---|
| InChI | InChI=1S/C18H17Cl2N3O4S2/c1-3-7-29(25,26)14-9-28-8-13(14)21-18(24)22-16-10(2)27-23-17(16)15-11(19)5-4-6-12(15)20/h4-6,8-9H,3,7H2,1-2H3,(H2,21,22,24) |
| InChIKey | TUBGQAKPIOHYNS-UHFFFAOYSA-N |
| Mol Weight | 474.38 g/mol |
| Molecular Formula | C18H17Cl2N3O4S2 |
| Exact Mass | 473.003754 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BA7Xarzlqwm |
|---|---|
| Name | 1-[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]-3-[4-(propylsulfonyl)-3-thienyl]urea |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H17Cl2N3O4S2 |
| InChI | InChI=1S/C18H17Cl2N3O4S2/c1-3-7-29(25,26)14-9-28-8-13(14)21-18(24)22-16-10(2)27-23-17(16)15-11(19)5-4-6-12(15)20/h4-6,8-9H,3,7H2,1-2H3,(H2,21,22,24) |
| InChIKey | TUBGQAKPIOHYNS-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 58491M |
| Solvent | Polysol |