SpectraBase Spectrum ID |
BYmBTqlDdih |
Name |
N-(1,3-benzodioxol-5-ylmethyl)-6-(2,4-dioxo-1-(2-oxo-2-phenylethyl)-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 |
533.162056769 u |
Formula |
C28H27N3O6S |
InChI |
InChI=1S/C28H27N3O6S/c32-22(20-7-3-1-4-8-20)17-31-21-12-14-38-26(21)27(34)30(28(31)35)13-6-2-5-9-25(33)29-16-19-10-11-23-24(15-19)37-18-36-23/h1,3-4,7-8,10-12,14-15H,2,5-6,9,13,16-18H2,(H,29,33) |
InChIKey |
GANDECVLOYAJOP-UHFFFAOYSA-N |
Molecular Weight |
533.599 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_6727 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12329066 |