![N-{3-[4-(2-fluorophenyl)-1-piperazinyl]propyl}-3-methyl-2-[(2-thienylsulfonyl)amino]butanamide](/api/spectrum/JzZpZZJnPTY/structure.png?h=300&w=458 "N-{3-[4-(2-fluorophenyl)-1-piperazinyl]propyl}-3-methyl-2-[(2-thienylsulfonyl)amino]butanamide")
| SpectraBase Compound ID | Aox7df8Erdd |
|---|---|
| InChI | InChI=1S/C22H31FN4O3S2/c1-17(2)21(25-32(29,30)20-9-5-16-31-20)22(28)24-10-6-11-26-12-14-27(15-13-26)19-8-4-3-7-18(19)23/h3-5,7-9,16-17,21,25H,6,10-15H2,1-2H3,(H,24,28) |
| InChIKey | IRDOGQGDLGDZOO-UHFFFAOYSA-N |
| Mol Weight | 482.63 g/mol |
| Molecular Formula | C22H31FN4O3S2 |
| Exact Mass | 482.182161 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | JzZpZZJnPTY |
|---|---|
| Name | N-{3-[4-(2-fluorophenyl)-1-piperazinyl]propyl}-3-methyl-2-[(2-thienylsulfonyl)amino]butanamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 482.182161382 u |
| Formula | C22H31FN4O3S2 |
| InChI | InChI=1S/C22H31FN4O3S2/c1-17(2)21(25-32(29,30)20-9-5-16-31-20)22(28)24-10-6-11-26-12-14-27(15-13-26)19-8-4-3-7-18(19)23/h3-5,7-9,16-17,21,25H,6,10-15H2,1-2H3,(H,24,28) |
| InChIKey | IRDOGQGDLGDZOO-UHFFFAOYSA-N |
| Molecular Weight | 482.633 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_795 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12268796 |