![ethyl 5-cyano-6-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-(2-furyl)-2-phenyl-1,4-dihydro-3-pyridinecarboxylate](/api/spectrum/KtkuXItUrl6/structure.png?h=300&w=458 "ethyl 5-cyano-6-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-(2-furyl)-2-phenyl-1,4-dihydro-3-pyridinecarboxylate")
| SpectraBase Compound ID | 3KvePA6CiUs |
|---|---|
| InChI | InChI=1S/C27H29N3O4S/c1-2-33-27(32)24-23(21-14-9-15-34-21)20(16-28)26(30-25(24)18-10-5-3-6-11-18)35-17-22(31)29-19-12-7-4-8-13-19/h3,5-6,9-11,14-15,19,23,30H,2,4,7-8,12-13,17H2,1H3,(H,29,31) |
| InChIKey | BFRIHGBQKRUYGQ-UHFFFAOYSA-N |
| Mol Weight | 491.61 g/mol |
| Molecular Formula | C27H29N3O4S |
| Exact Mass | 491.187878 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | KtkuXItUrl6 |
|---|---|
| Name | ethyl 5-cyano-6-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-(2-furyl)-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 | 491.187877596 u |
| Formula | C27H29N3O4S |
| InChI | InChI=1S/C27H29N3O4S/c1-2-33-27(32)24-23(21-14-9-15-34-21)20(16-28)26(30-25(24)18-10-5-3-6-11-18)35-17-22(31)29-19-12-7-4-8-13-19/h3,5-6,9-11,14-15,19,23,30H,2,4,7-8,12-13,17H2,1H3,(H,29,31) |
| InChIKey | BFRIHGBQKRUYGQ-UHFFFAOYSA-N |
| Molecular Weight | 491.606 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_1667 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12278245 |