SpectraBase Spectrum ID |
4HSBR5ic373 |
Name |
2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-(2-ethoxyphenyl)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 |
561.215823676 u |
Formula |
C28H31N7O4S |
InChI |
InChI=1S/C28H31N7O4S/c1-6-39-22-10-8-7-9-20(22)29-26(36)16-40-28-30-21-15-24(38-5)23(37-4)14-19(21)27-31-25(33-35(27)28)11-12-34-18(3)13-17(2)32-34/h7-10,13-15H,6,11-12,16H2,1-5H3,(H,29,36) |
InChIKey |
JPDQNOFXSQHHSK-UHFFFAOYSA-N |
Molecular Weight |
561.661 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_7090 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12329617 |