![N-(4-ethoxyphenyl)-2-{3-[2-(4-methyl-1-piperazinyl)ethyl]-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-thioxo-4-imidazolidinyl}acetamide](/api/spectrum/EDBIWA829ZU/structure.png?h=300&w=458 "N-(4-ethoxyphenyl)-2-{3-[2-(4-methyl-1-piperazinyl)ethyl]-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-thioxo-4-imidazolidinyl}acetamide")
| SpectraBase Compound ID | IIUWR9EXNJo |
|---|---|
| InChI | InChI=1S/C27H35N5O3S2/c1-4-35-22-10-8-20(9-11-22)28-25(33)19-24-26(34)32(21-6-5-7-23(18-21)37-3)27(36)31(24)17-16-30-14-12-29(2)13-15-30/h5-11,18,24H,4,12-17,19H2,1-3H3,(H,28,33) |
| InChIKey | HRVJBTWEDLGAEO-UHFFFAOYSA-N |
| Mol Weight | 541.7 g/mol |
| Molecular Formula | C27H35N5O3S2 |
| Exact Mass | 541.218132 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | EDBIWA829ZU |
|---|---|
| Name | N-(4-ethoxyphenyl)-2-{3-[2-(4-methyl-1-piperazinyl)ethyl]-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-thioxo-4-imidazolidinyl}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 | 541.218132352 u |
| Formula | C27H35N5O3S2 |
| InChI | InChI=1S/C27H35N5O3S2/c1-4-35-22-10-8-20(9-11-22)28-25(33)19-24-26(34)32(21-6-5-7-23(18-21)37-3)27(36)31(24)17-16-30-14-12-29(2)13-15-30/h5-11,18,24H,4,12-17,19H2,1-3H3,(H,28,33) |
| InChIKey | HRVJBTWEDLGAEO-UHFFFAOYSA-N |
| Molecular Weight | 541.729 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_2496 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12279538 |