![2-{1-(3-chlorophenyl)-3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-2-thioxo-4-imidazolidinyl}-N-(4-propoxyphenyl)acetamide](/api/spectrum/HDQKiEqCgmW/structure.png?h=300&w=458 "2-{1-(3-chlorophenyl)-3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-2-thioxo-4-imidazolidinyl}-N-(4-propoxyphenyl)acetamide")
| SpectraBase Compound ID | LqkYyiWMiXj |
|---|---|
| InChI | InChI=1S/C28H35ClN4O3S/c1-3-17-36-24-9-7-22(8-10-24)30-26(34)19-25-27(35)33(23-6-4-5-21(29)18-23)28(37)32(25)16-15-31-13-11-20(2)12-14-31/h4-10,18,20,25H,3,11-17,19H2,1-2H3,(H,30,34) |
| InChIKey | QBBSIPIANAFSFY-UHFFFAOYSA-N |
| Mol Weight | 543.1 g/mol |
| Molecular Formula | C28H35ClN4O3S |
| Exact Mass | 542.21184 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | HDQKiEqCgmW |
|---|---|
| Name | 2-{1-(3-chlorophenyl)-3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-2-thioxo-4-imidazolidinyl}-N-(4-propoxyphenyl)acetamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 542.211839874 u |
| Formula | C28H35ClN4O3S |
| InChI | InChI=1S/C28H35ClN4O3S/c1-3-17-36-24-9-7-22(8-10-24)30-26(34)19-25-27(35)33(23-6-4-5-21(29)18-23)28(37)32(25)16-15-31-13-11-20(2)12-14-31/h4-10,18,20,25H,3,11-17,19H2,1-2H3,(H,30,34) |
| InChIKey | QBBSIPIANAFSFY-UHFFFAOYSA-N |
| Molecular Weight | 543.126 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_2510 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12279552 |