![N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,1-dioxido-2H-1,2,4-benzothiadiazin-3-yl)butanamide](/api/spectrum/FsDrGK2zfol/structure.png?h=300&w=458 "N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,1-dioxido-2H-1,2,4-benzothiadiazin-3-yl)butanamide")
| SpectraBase Compound ID | CX4Plp6zzJa |
|---|---|
| InChI | InChI=1S/C21H25N3O5S/c1-28-17-11-10-15(14-18(17)29-2)12-13-22-21(25)9-5-8-20-23-16-6-3-4-7-19(16)30(26,27)24-20/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3,(H,22,25)(H,23,24) |
| InChIKey | VLGORCAGQJQPDP-UHFFFAOYSA-N |
| Mol Weight | 431.51 g/mol |
| Molecular Formula | C21H25N3O5S |
| Exact Mass | 431.151492 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | FsDrGK2zfol |
|---|---|
| Name | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,1-dioxido-2H-1,2,4-benzothiadiazin-3-yl)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 | 431.151492086 u |
| Formula | C21H25N3O5S |
| InChI | InChI=1S/C21H25N3O5S/c1-28-17-11-10-15(14-18(17)29-2)12-13-22-21(25)9-5-8-20-23-16-6-3-4-7-19(16)30(26,27)24-20/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3,(H,22,25)(H,23,24) |
| InChIKey | VLGORCAGQJQPDP-UHFFFAOYSA-N |
| Molecular Weight | 431.507 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_7284 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13218023 |