SpectraBase Spectrum ID |
6IPRb5ycJrO |
Name |
2-{1-allyl-3-[3-(4-benzyl-1-piperazinyl)propyl]-5-oxo-2-thioxo-4-imidazolidinyl}-N-(4-chlorophenyl)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 |
539.212174227 u |
Formula |
C28H34ClN5O2S |
InChI |
InChI=1S/C28H34ClN5O2S/c1-2-13-34-27(36)25(20-26(35)30-24-11-9-23(29)10-12-24)33(28(34)37)15-6-14-31-16-18-32(19-17-31)21-22-7-4-3-5-8-22/h2-5,7-12,25H,1,6,13-21H2,(H,30,35) |
InChIKey |
VKWFFADNUFENGG-UHFFFAOYSA-N |
Molecular Weight |
540.126 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_5436 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12319137 |