SpectraBase Spectrum ID |
CyzR3DttMDa |
Name |
2-{1-(4-ethoxyphenyl)-3-[2-(4-methyl-1-piperidinyl)ethyl]-5-oxo-2-thioxo-4-imidazolidinyl}-N-(4-fluorophenyl)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 |
512.225740273 u |
Formula |
C27H33FN4O3S |
InChI |
InChI=1S/C27H33FN4O3S/c1-3-35-23-10-8-22(9-11-23)32-26(34)24(18-25(33)29-21-6-4-20(28)5-7-21)31(27(32)36)17-16-30-14-12-19(2)13-15-30/h4-11,19,24H,3,12-18H2,1-2H3,(H,29,33) |
InChIKey |
FEZCMRPWFFYQFA-UHFFFAOYSA-N |
Molecular Weight |
512.644 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_2468 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12279509 |