SpectraBase Spectrum ID |
JUtOgrgx2dP |
Name |
ethyl 4-[({1-(4-methylphenyl)-3-[3-(4-methyl-1-piperazinyl)propyl]-5-oxo-2-thioxo-4-imidazolidinyl}acetyl)amino]benzoate |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
551.256625861 u |
Formula |
C29H37N5O4S |
InChI |
InChI=1S/C29H37N5O4S/c1-4-38-28(37)22-8-10-23(11-9-22)30-26(35)20-25-27(36)34(24-12-6-21(2)7-13-24)29(39)33(25)15-5-14-32-18-16-31(3)17-19-32/h6-13,25H,4-5,14-20H2,1-3H3,(H,30,35) |
InChIKey |
MHBOKXPVWZSJJE-UHFFFAOYSA-N |
Molecular Weight |
551.706 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_2494 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12279536 |