| SpectraBase Spectrum ID |
LL6ro1wIyX0 |
| Name |
N-(1,3-benzodioxol-5-ylmethyl)-6-(1-(2-cyanobenzyl)-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 |
530.162391122 u |
| Formula |
C28H26N4O5S |
| InChI |
InChI=1S/C28H26N4O5S/c29-15-20-6-3-4-7-21(20)17-32-22-11-13-38-26(22)27(34)31(28(32)35)12-5-1-2-8-25(33)30-16-19-9-10-23-24(14-19)37-18-36-23/h3-4,6-7,9-11,13-14H,1-2,5,8,12,16-18H2,(H,30,33) |
| InChIKey |
RACLRPKDQSLCES-UHFFFAOYSA-N |
| Molecular Weight |
530.599 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_6741 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12329084 |
![N-(1,3-benzodioxol-5-ylmethyl)-6-(1-(2-cyanobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide](/api/spectrum/LL6ro1wIyX0/structure.png?h=300&w=458 "N-(1,3-benzodioxol-5-ylmethyl)-6-(1-(2-cyanobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide")
