SpectraBase Spectrum ID |
LfgtzKfrDZL |
Name |
2-{[3-(2-hydroxyethyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(4-methylbenzyl)acetamide |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
439.102433893 u |
Formula |
C22H21N3O3S2 |
InChI |
InChI=1S/C22H21N3O3S2/c1-14-6-8-15(9-7-14)12-23-18(27)13-29-22-24-19-16-4-2-3-5-17(16)30-20(19)21(28)25(22)10-11-26/h2-9,26H,10-13H2,1H3,(H,23,27) |
InChIKey |
WWRKRJQQYKGOQU-UHFFFAOYSA-N |
Molecular Weight |
439.548 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_7796 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13218541 |