SpectraBase Compound ID | Cgg3PFyxn7N |
---|---|
InChI | InChI=1S/C21H20N2O4S2/c1-15-4-8-18(9-5-15)23-21(25)16-6-10-17(11-7-16)22-19(24)12-14-29(26,27)20-3-2-13-28-20/h2-11,13H,12,14H2,1H3,(H,22,24)(H,23,25) |
InChIKey | WZVKDNXQHPSMOJ-UHFFFAOYSA-N |
Mol Weight | 428.52 g/mol |
Molecular Formula | C21H20N2O4S2 |
Exact Mass | 428.086449 g/mol |
SpectraBase Spectrum ID | Hp9QwROABqm |
---|---|
Name | N-(4-methylphenyl)-4-{[3-(2-thienylsulfonyl)propanoyl]amino}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 | 428.086449476 u |
Formula | C21H20N2O4S2 |
InChI | InChI=1S/C21H20N2O4S2/c1-15-4-8-18(9-5-15)23-21(25)16-6-10-17(11-7-16)22-19(24)12-14-29(26,27)20-3-2-13-28-20/h2-11,13H,12,14H2,1H3,(H,22,24)(H,23,25) |
InChIKey | WZVKDNXQHPSMOJ-UHFFFAOYSA-N |
Molecular Weight | 428.521 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_1199 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12269309 |