![4-imidazolidineacetamide, N-(4-methoxyphenyl)-1-[3-(methylthio)phenyl]-5-oxo-3-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-2-thioxo-](/api/spectrum/3AYYCBJhRoe/structure.png?h=300&w=458 "4-imidazolidineacetamide, N-(4-methoxyphenyl)-1-[3-(methylthio)phenyl]-5-oxo-3-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-2-thioxo-")
| SpectraBase Compound ID | 5FZsNG0pg7r |
|---|---|
| InChI | InChI=1S/C33H39N5O3S2/c1-41-28-14-12-26(13-15-28)34-31(39)23-30-32(40)38(27-10-6-11-29(22-27)43-2)33(42)37(30)17-7-16-35-18-20-36(21-19-35)24-25-8-4-3-5-9-25/h3-6,8-15,22,30H,7,16-21,23-24H2,1-2H3,(H,34,39) |
| InChIKey | FSEGCFHUYLDRBY-UHFFFAOYSA-N |
| Mol Weight | 617.8 g/mol |
| Molecular Formula | C33H39N5O3S2 |
| Exact Mass | 617.249432 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 3AYYCBJhRoe |
|---|---|
| Name | 4-imidazolidineacetamide, N-(4-methoxyphenyl)-1-[3-(methylthio)phenyl]-5-oxo-3-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-2-thioxo- |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 617.249432481 u |
| Formula | C33H39N5O3S2 |
| InChI | InChI=1S/C33H39N5O3S2/c1-41-28-14-12-26(13-15-28)34-31(39)23-30-32(40)38(27-10-6-11-29(22-27)43-2)33(42)37(30)17-7-16-35-18-20-36(21-19-35)24-25-8-4-3-5-9-25/h3-6,8-15,22,30H,7,16-21,23-24H2,1-2H3,(H,34,39) |
| InChIKey | FSEGCFHUYLDRBY-UHFFFAOYSA-N |
| Molecular Weight | 617.827 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2021_451 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13238922 |