SpectraBase Spectrum ID |
1Ps8ndpwRI2 |
Name |
3-thiophenecarboxylic acid, 5-[[(3-chloro-2-methylphenyl)amino]carbonyl]-2-[[(4-methoxyphenyl)acetyl]amino]-4-methyl-, |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
500.117270782 u |
Formula |
C25H25ClN2O5S |
InChI |
InChI=1S/C25H25ClN2O5S/c1-5-33-25(31)21-15(3)22(23(30)27-19-8-6-7-18(26)14(19)2)34-24(21)28-20(29)13-16-9-11-17(32-4)12-10-16/h6-12H,5,13H2,1-4H3,(H,27,30)(H,28,29) |
InChIKey |
XNOSLQLGXNOLPJ-UHFFFAOYSA-N |
Molecular Weight |
500.997 g/mol |
NMR Offset |
16.0087 |
NMR Spectrometer Frequency |
500.133 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_5153 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9312172; Lab Info: SAS; Lab Number: SAS-tst3143 |