| SpectraBase Spectrum ID |
25R2RVFUBcd |
| Name |
1,4-benzenedicarboxylic acid, 2-[[[4-(2-pyridinyl)-1-piperazinyl]carbonothioyl]amino]-, dimethyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
414.136176374 u |
| Formula |
C20H22N4O4S |
| InChI |
InChI=1S/C20H22N4O4S/c1-27-18(25)14-6-7-15(19(26)28-2)16(13-14)22-20(29)24-11-9-23(10-12-24)17-5-3-4-8-21-17/h3-8,13H,9-12H2,1-2H3,(H,22,29) |
| InChIKey |
NLVFQPYQEZLWNX-UHFFFAOYSA-N |
| Molecular Weight |
414.480 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_1021 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13239606 |
![1,4-benzenedicarboxylic acid, 2-[[[4-(2-pyridinyl)-1-piperazinyl]carbonothioyl]amino]-, dimethyl ester](/api/spectrum/25R2RVFUBcd/structure.png?h=300&w=458 "1,4-benzenedicarboxylic acid, 2-[[[4-(2-pyridinyl)-1-piperazinyl]carbonothioyl]amino]-, dimethyl ester")
