![2-(5-bromo-2-thienyl)-N-{2-[(ethoxyacetyl)amino]ethyl}-4-quinolinecarboxamide](/api/spectrum/6rttzLHp28D/structure.png?h=300&w=458 "2-(5-bromo-2-thienyl)-N-{2-[(ethoxyacetyl)amino]ethyl}-4-quinolinecarboxamide")
| SpectraBase Compound ID | HTLwOJq0g0V |
|---|---|
| InChI | InChI=1S/C20H20BrN3O3S/c1-2-27-12-19(25)22-9-10-23-20(26)14-11-16(17-7-8-18(21)28-17)24-15-6-4-3-5-13(14)15/h3-8,11H,2,9-10,12H2,1H3,(H,22,25)(H,23,26) |
| InChIKey | KJMYXGKQFNACQQ-UHFFFAOYSA-N |
| Mol Weight | 462.36 g/mol |
| Molecular Formula | C20H20BrN3O3S |
| Exact Mass | 461.040876 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 6rttzLHp28D |
|---|---|
| Name | 2-(5-bromo-2-thienyl)-N-{2-[(ethoxyacetyl)amino]ethyl}-4-quinolinecarboxamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 461.040875687 u |
| Formula | C20H20BrN3O3S |
| InChI | InChI=1S/C20H20BrN3O3S/c1-2-27-12-19(25)22-9-10-23-20(26)14-11-16(17-7-8-18(21)28-17)24-15-6-4-3-5-13(14)15/h3-8,11H,2,9-10,12H2,1H3,(H,22,25)(H,23,26) |
| InChIKey | KJMYXGKQFNACQQ-UHFFFAOYSA-N |
| Molecular Weight | 462.362 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_4436 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12309356 |