| SpectraBase Spectrum ID |
CQXE1RAUHrL |
| Name |
benzoic acid, 4-[[[4-[(4-chlorophenyl)methyl]-1-piperazinyl]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 |
417.127775897 u |
| Formula |
C21H24ClN3O2S |
| InChI |
InChI=1S/C21H24ClN3O2S/c1-2-27-20(26)17-5-9-19(10-6-17)23-21(28)25-13-11-24(12-14-25)15-16-3-7-18(22)8-4-16/h3-10H,2,11-15H2,1H3,(H,23,28) |
| InChIKey |
VYAZXIYAMNWIHM-UHFFFAOYSA-N |
| Molecular Weight |
417.955 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_6660 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10220233; Lab Info: PE; Lab Number: PE-0790202 |
![benzoic acid, 4-[[[4-[(4-chlorophenyl)methyl]-1-piperazinyl]carbonothioyl]amino]-, ethyl ester](/api/spectrum/CQXE1RAUHrL/structure.png?h=300&w=458 "benzoic acid, 4-[[[4-[(4-chlorophenyl)methyl]-1-piperazinyl]carbonothioyl]amino]-, ethyl ester")
