| SpectraBase Spectrum ID |
7Z7pzTxWYMu |
| Name |
N-(1,3-benzodioxol-5-ylmethyl)-6-(1-(2-chlorobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
539.128169818 u |
| Formula |
C27H26ClN3O5S |
| InChI |
InChI=1S/C27H26ClN3O5S/c28-20-7-4-3-6-19(20)16-31-21-11-13-37-25(21)26(33)30(27(31)34)12-5-1-2-8-24(32)29-15-18-9-10-22-23(14-18)36-17-35-22/h3-4,6-7,9-11,13-14H,1-2,5,8,12,15-17H2,(H,29,32) |
| InChIKey |
XJQHJHIOWNAGQX-UHFFFAOYSA-N |
| Molecular Weight |
540.034 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_6729 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12329069 |
![N-(1,3-benzodioxol-5-ylmethyl)-6-(1-(2-chlorobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide](/api/spectrum/7Z7pzTxWYMu/structure.png?h=300&w=458 "N-(1,3-benzodioxol-5-ylmethyl)-6-(1-(2-chlorobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide")
