| SpectraBase Spectrum ID |
G3LGpt9F883 |
| Name |
1-{[3-(3-bromophenyl)-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]methyl}-4-piperidinecarboxamide |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
471.072844521 u |
| Formula |
C21H22BrN5OS |
| InChI |
InChI=1S/C21H22BrN5OS/c22-17-6-4-5-16(13-17)20-24-26(14-25-11-9-15(10-12-25)19(23)28)21(29)27(20)18-7-2-1-3-8-18/h1-8,13,15H,9-12,14H2,(H2,23,28) |
| InChIKey |
VWJJNZKSNLDMGG-UHFFFAOYSA-N |
| Molecular Weight |
472.405 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_5294 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12318609 |
![1-{[3-(3-bromophenyl)-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]methyl}-4-piperidinecarboxamide](/api/spectrum/G3LGpt9F883/structure.png?h=300&w=458 "1-{[3-(3-bromophenyl)-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]methyl}-4-piperidinecarboxamide")
