| SpectraBase Spectrum ID |
3C3xya7WDbH |
| Name |
ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-oxo-2-(2-toluidino)ethyl]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 |
543.138340580 u |
| Formula |
C30H26ClN3O3S |
| InChI |
InChI=1S/C30H26ClN3O3S/c1-3-37-30(36)27-26(21-14-8-9-15-23(21)31)22(17-32)29(34-28(27)20-12-5-4-6-13-20)38-18-25(35)33-24-16-10-7-11-19(24)2/h4-16,26,34H,3,18H2,1-2H3,(H,33,35) |
| InChIKey |
XHJKMMCCDQLUEO-UHFFFAOYSA-N |
| Molecular Weight |
544.069 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_1658 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12278230 |
![ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-oxo-2-(2-toluidino)ethyl]sulfanyl}-2-phenyl-1,4-dihydro-3-pyridinecarboxylate](/api/spectrum/3C3xya7WDbH/structure.png?h=300&w=458 "ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-oxo-2-(2-toluidino)ethyl]sulfanyl}-2-phenyl-1,4-dihydro-3-pyridinecarboxylate")
