![2-{3-[3-(4-benzyl-1-piperazinyl)propyl]-5-oxo-1-phenyl-2-thioxo-4-imidazolidinyl}-N-(4-propoxyphenyl)acetamide](/api/spectrum/7aGp1wF28IA/structure.png?h=300&w=458 "2-{3-[3-(4-benzyl-1-piperazinyl)propyl]-5-oxo-1-phenyl-2-thioxo-4-imidazolidinyl}-N-(4-propoxyphenyl)acetamide")
| SpectraBase Compound ID | 4X8djkqUNnu |
|---|---|
| InChI | InChI=1S/C34H41N5O3S/c1-2-24-42-30-16-14-28(15-17-30)35-32(40)25-31-33(41)39(29-12-7-4-8-13-29)34(43)38(31)19-9-18-36-20-22-37(23-21-36)26-27-10-5-3-6-11-27/h3-8,10-17,31H,2,9,18-26H2,1H3,(H,35,40) |
| InChIKey | GJSMFBIFWMGJEU-UHFFFAOYSA-N |
| Mol Weight | 599.8 g/mol |
| Molecular Formula | C34H41N5O3S |
| Exact Mass | 599.293011 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 7aGp1wF28IA |
|---|---|
| Name | 2-{3-[3-(4-benzyl-1-piperazinyl)propyl]-5-oxo-1-phenyl-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 | 599.293011371 u |
| Formula | C34H41N5O3S |
| InChI | InChI=1S/C34H41N5O3S/c1-2-24-42-30-16-14-28(15-17-30)35-32(40)25-31-33(41)39(29-12-7-4-8-13-29)34(43)38(31)19-9-18-36-20-22-37(23-21-36)26-27-10-5-3-6-11-27/h3-8,10-17,31H,2,9,18-26H2,1H3,(H,35,40) |
| InChIKey | GJSMFBIFWMGJEU-UHFFFAOYSA-N |
| Molecular Weight | 599.794 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_5425 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12319126 |