![N-[(benzo[b]thien-3-yl)methyl]-3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarboxamide](/api/spectrum/HYYMqwKHuXe/structure.png?h=300&w=458 "N-[(benzo[b]thien-3-yl)methyl]-3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarboxamide")
| SpectraBase Compound ID | AOxebbhip26 |
|---|---|
| InChI | InChI=1S/C20H14Cl2N2O2S/c1-11-17(19(24-26-11)18-14(21)6-4-7-15(18)22)20(25)23-9-12-10-27-16-8-3-2-5-13(12)16/h2-8,10H,9H2,1H3,(H,23,25) |
| InChIKey | IVRLNBAORZOTOF-UHFFFAOYSA-N |
| Mol Weight | 417.31 g/mol |
| Molecular Formula | C20H14Cl2N2O2S |
| Exact Mass | 416.015304 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HYYMqwKHuXe |
|---|---|
| Name | N-[(benzo[b]thien-3-yl)methyl]-3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarboxamide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H14Cl2N2O2S |
| InChI | InChI=1S/C20H14Cl2N2O2S/c1-11-17(19(24-26-11)18-14(21)6-4-7-15(18)22)20(25)23-9-12-10-27-16-8-3-2-5-13(12)16/h2-8,10H,9H2,1H3,(H,23,25) |
| InChIKey | IVRLNBAORZOTOF-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 48744M |
| Solvent | CDCl3 |