SpectraBase Spectrum ID |
2jhi6lVnqJ3 |
Name |
2-{[3-cyano-4-(4-fluorophenyl)-6-oxo-1,4,5,6-tetrahydro-2-pyridinyl]sulfanyl}-N-(4-methoxyphenyl)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 |
411.105290786 u |
Formula |
C21H18FN3O3S |
InChI |
InChI=1S/C21H18FN3O3S/c1-28-16-8-6-15(7-9-16)24-20(27)12-29-21-18(11-23)17(10-19(26)25-21)13-2-4-14(22)5-3-13/h2-9,17H,10,12H2,1H3,(H,24,27)(H,25,26) |
InChIKey |
HKEKIIKBCNOPSH-UHFFFAOYSA-N |
Molecular Weight |
411.451 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_1730 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12278319 |