![4-{[3-(2-thienylsulfonyl)propanoyl]amino}-N-[4-(trifluoromethyl)phenyl]benzamide](/api/spectrum/H61ogAvOPe1/structure.png?h=300&w=458 "4-{[3-(2-thienylsulfonyl)propanoyl]amino}-N-[4-(trifluoromethyl)phenyl]benzamide")
| SpectraBase Compound ID | 4nstTFbaTfC |
|---|---|
| InChI | InChI=1S/C21H17F3N2O4S2/c22-21(23,24)15-5-9-17(10-6-15)26-20(28)14-3-7-16(8-4-14)25-18(27)11-13-32(29,30)19-2-1-12-31-19/h1-10,12H,11,13H2,(H,25,27)(H,26,28) |
| InChIKey | VRRVQBLSVRZQRI-UHFFFAOYSA-N |
| Mol Weight | 482.49 g/mol |
| Molecular Formula | C21H17F3N2O4S2 |
| Exact Mass | 482.058184 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | H61ogAvOPe1 |
|---|---|
| Name | 4-{[3-(2-thienylsulfonyl)propanoyl]amino}-N-[4-(trifluoromethyl)phenyl]benzamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 482.058183868 u |
| Formula | C21H17F3N2O4S2 |
| InChI | InChI=1S/C21H17F3N2O4S2/c22-21(23,24)15-5-9-17(10-6-15)26-20(28)14-3-7-16(8-4-14)25-18(27)11-13-32(29,30)19-2-1-12-31-19/h1-10,12H,11,13H2,(H,25,27)(H,26,28) |
| InChIKey | VRRVQBLSVRZQRI-UHFFFAOYSA-N |
| Molecular Weight | 482.492 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_1197 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12269307 |