| SpectraBase Spectrum ID |
4UGesTElJN1 |
| Name |
benzoic acid, 4-[[[[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]ethyl]amino]carbonothioyl]amino]-, ethyl 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 |
460.169975062 u |
| Formula |
C23H29ClN4O2S |
| InChI |
InChI=1S/C23H29ClN4O2S/c1-3-30-22(29)18-5-8-20(9-6-18)26-23(31)25-10-11-27-12-14-28(15-13-27)21-16-19(24)7-4-17(21)2/h4-9,16H,3,10-15H2,1-2H3,(H2,25,26,31) |
| InChIKey |
SIPURLXHWXUVIL-UHFFFAOYSA-N |
| Molecular Weight |
461.024 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_522 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13239012 |
![benzoic acid, 4-[[[[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]ethyl]amino]carbonothioyl]amino]-, ethyl ester](/api/spectrum/4UGesTElJN1/structure.png?h=300&w=458 "benzoic acid, 4-[[[[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]ethyl]amino]carbonothioyl]amino]-, ethyl ester")
