SpectraBase Compound ID | HRwdnhSwrlm |
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InChI | InChI=1S/C34H40ClN5O4S/c1-3-22-44-28-13-10-25(11-14-28)36-32(41)24-30-33(42)40(27-12-15-31(43-2)29(35)23-27)34(45)39(30)17-7-16-37-18-20-38(21-19-37)26-8-5-4-6-9-26/h4-6,8-15,23,30H,3,7,16-22,24H2,1-2H3,(H,36,41) |
InChIKey | IJQMRYIFOLIOHA-UHFFFAOYSA-N |
Mol Weight | 650.2 g/mol |
Molecular Formula | C34H40ClN5O4S |
Exact Mass | 649.248954 g/mol |
SpectraBase Spectrum ID | JSLi4KfISrZ |
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Name | 4-imidazolidineacetamide, 1-(3-chloro-4-methoxyphenyl)-5-oxo-3-[3-(4-phenyl-1-piperazinyl)propyl]-N-(4-propoxyphenyl)-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 | 649.248953658 u |
Formula | C34H40ClN5O4S |
InChI | InChI=1S/C34H40ClN5O4S/c1-3-22-44-28-13-10-25(11-14-28)36-32(41)24-30-33(42)40(27-12-15-31(43-2)29(35)23-27)34(45)39(30)17-7-16-37-18-20-38(21-19-37)26-8-5-4-6-9-26/h4-6,8-15,23,30H,3,7,16-22,24H2,1-2H3,(H,36,41) |
InChIKey | IJQMRYIFOLIOHA-UHFFFAOYSA-N |
Molecular Weight | 650.238 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2021_496 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13238975 |