| SpectraBase Spectrum ID |
CL6n3XUy0YI |
| Name |
ethyl 4-(4-chlorophenyl)-5-cyano-6-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-2-phenyl-1,4-dihydro-3-pyridinecarboxylate |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
547.113268647 u |
| Formula |
C29H23ClFN3O3S |
| InChI |
InChI=1S/C29H23ClFN3O3S/c1-2-37-29(36)26-25(18-8-10-20(30)11-9-18)23(16-32)28(34-27(26)19-6-4-3-5-7-19)38-17-24(35)33-22-14-12-21(31)13-15-22/h3-15,25,34H,2,17H2,1H3,(H,33,35) |
| InChIKey |
KBYFVYAXAYINPZ-UHFFFAOYSA-N |
| Molecular Weight |
548.032 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_1660 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12278233 |
![ethyl 4-(4-chlorophenyl)-5-cyano-6-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-2-phenyl-1,4-dihydro-3-pyridinecarboxylate](/api/spectrum/CL6n3XUy0YI/structure.png?h=300&w=458 "ethyl 4-(4-chlorophenyl)-5-cyano-6-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-2-phenyl-1,4-dihydro-3-pyridinecarboxylate")
