SpectraBase Compound ID | 7hN86iQcWza |
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InChI | InChI=1S/C32H36ClN5O3S/c1-2-41-28-14-12-25(13-15-28)34-30(39)23-29-31(40)38(27-11-6-8-24(33)22-27)32(42)37(29)17-7-16-35-18-20-36(21-19-35)26-9-4-3-5-10-26/h3-6,8-15,22,29H,2,7,16-21,23H2,1H3,(H,34,39) |
InChIKey | KQKAORAWBUFXCE-UHFFFAOYSA-N |
Mol Weight | 606.2 g/mol |
Molecular Formula | C32H36ClN5O3S |
Exact Mass | 605.222739 g/mol |
SpectraBase Spectrum ID | 393J67HJcqT |
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Name | 4-imidazolidineacetamide, 1-(3-chlorophenyl)-N-(4-ethoxyphenyl)-5-oxo-3-[3-(4-phenyl-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 | 605.222738910 u |
Formula | C32H36ClN5O3S |
InChI | InChI=1S/C32H36ClN5O3S/c1-2-41-28-14-12-25(13-15-28)34-30(39)23-29-31(40)38(27-11-6-8-24(33)22-27)32(42)37(29)17-7-16-35-18-20-36(21-19-35)26-9-4-3-5-10-26/h3-6,8-15,22,29H,2,7,16-21,23H2,1H3,(H,34,39) |
InChIKey | KQKAORAWBUFXCE-UHFFFAOYSA-N |
Molecular Weight | 606.185 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2021_488 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13238967 |