SpectraBase Spectrum ID |
EaxoD4ypKCw |
Name |
2-{[3-cyano-4-(3-ethoxy-4-hydroxyphenyl)-6-oxo-1,4,5,6-tetrahydro-2-pyridinyl]sulfanyl}-N-(4-fluorophenyl)acetamide |
Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
441.115855469 u |
Formula |
C22H20FN3O4S |
InChI |
InChI=1S/C22H20FN3O4S/c1-2-30-19-9-13(3-8-18(19)27)16-10-20(28)26-22(17(16)11-24)31-12-21(29)25-15-6-4-14(23)5-7-15/h3-9,16,27H,2,10,12H2,1H3,(H,25,29)(H,26,28) |
InChIKey |
NXDFAWLXYXNSJX-UHFFFAOYSA-N |
Molecular Weight |
441.477 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_1738 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12278329 |