SpectraBase Spectrum ID |
LGpwE9NWp5K |
Name |
4-(4-oxo-6-{[4-(trifluoromethyl)benzyl]sulfanyl}-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-1-yl)benzenesulfonamide |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
481.049016165 u |
Formula |
C19H14F3N5O3S2 |
InChI |
InChI=1S/C19H14F3N5O3S2/c20-19(21,22)12-3-1-11(2-4-12)10-31-18-25-16-15(17(28)26-18)9-24-27(16)13-5-7-14(8-6-13)32(23,29)30/h1-9H,10H2,(H2,23,29,30)(H,25,26,28) |
InChIKey |
XYOCNIDLSBWHCR-UHFFFAOYSA-N |
Molecular Weight |
481.468 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_5096 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12318337 |