SpectraBase Spectrum ID |
3YAmBqK3AsU |
Name |
2-{[3-(2-hydroxyethyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(4-isopropylphenyl)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 |
453.118083958 u |
Formula |
C23H23N3O3S2 |
InChI |
InChI=1S/C23H23N3O3S2/c1-14(2)15-7-9-16(10-8-15)24-19(28)13-30-23-25-20-17-5-3-4-6-18(17)31-21(20)22(29)26(23)11-12-27/h3-10,14,27H,11-13H2,1-2H3,(H,24,28) |
InChIKey |
QSHOKDVSYWAYPK-UHFFFAOYSA-N |
Molecular Weight |
453.575 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_7794 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13218539 |