SpectraBase Spectrum ID |
DCNlmbRJAlN |
Name |
2-[(3-chlorobenzyl)sulfanyl]-3-(3-methoxypropyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
430.057647906 u |
Formula |
C21H19ClN2O2S2 |
InChI |
InChI=1S/C21H19ClN2O2S2/c1-26-11-5-10-24-20(25)19-18(16-8-2-3-9-17(16)28-19)23-21(24)27-13-14-6-4-7-15(22)12-14/h2-4,6-9,12H,5,10-11,13H2,1H3 |
InChIKey |
ASGYSFIGQKTKIE-UHFFFAOYSA-N |
Molecular Weight |
430.968 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_7106 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12329641 |