![2-(5-chloro-2-thienyl)-N-[3-(diisobutylamino)propyl]-4-quinolinecarboxamide](/api/spectrum/2SeN0AIYgvh/structure.png?h=300&w=458 "2-(5-chloro-2-thienyl)-N-[3-(diisobutylamino)propyl]-4-quinolinecarboxamide")
| SpectraBase Compound ID | 78JahddTLak |
|---|---|
| InChI | InChI=1S/C25H32ClN3OS/c1-17(2)15-29(16-18(3)4)13-7-12-27-25(30)20-14-22(23-10-11-24(26)31-23)28-21-9-6-5-8-19(20)21/h5-6,8-11,14,17-18H,7,12-13,15-16H2,1-4H3,(H,27,30) |
| InChIKey | AGHVUKIJYRTBJC-UHFFFAOYSA-N |
| Mol Weight | 458.1 g/mol |
| Molecular Formula | C25H32ClN3OS |
| Exact Mass | 457.195462 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 2SeN0AIYgvh |
|---|---|
| Name | 2-(5-chloro-2-thienyl)-N-[3-(diisobutylamino)propyl]-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 | 457.195461535 u |
| Formula | C25H32ClN3OS |
| InChI | InChI=1S/C25H32ClN3OS/c1-17(2)15-29(16-18(3)4)13-7-12-27-25(30)20-14-22(23-10-11-24(26)31-23)28-21-9-6-5-8-19(20)21/h5-6,8-11,14,17-18H,7,12-13,15-16H2,1-4H3,(H,27,30) |
| InChIKey | AGHVUKIJYRTBJC-UHFFFAOYSA-N |
| Molecular Weight | 458.064 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_5076 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12318285 |