| SpectraBase Spectrum ID |
KidxIEMv5dZ |
| Name |
ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(2,6-dimethylanilino)-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 |
557.153990645 u |
| Formula |
C31H28ClN3O3S |
| InChI |
InChI=1S/C31H28ClN3O3S/c1-4-38-31(37)27-26(22-15-8-9-16-24(22)32)23(17-33)30(35-29(27)21-13-6-5-7-14-21)39-18-25(36)34-28-19(2)11-10-12-20(28)3/h5-16,26,35H,4,18H2,1-3H3,(H,34,36) |
| InChIKey |
QWOWDMHPEXYKMU-UHFFFAOYSA-N |
| Molecular Weight |
558.096 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_1719 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12278300 |
![ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl}-2-phenyl-1,4-dihydro-3-pyridinecarboxylate](/api/spectrum/KidxIEMv5dZ/structure.png?h=300&w=458 "ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl}-2-phenyl-1,4-dihydro-3-pyridinecarboxylate")
