| SpectraBase Spectrum ID |
5KRMBK9x0y2 |
| Name |
2-[(4-chlorobenzyl)sulfanyl]-N,7-bis(4-chlorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
555.045414557 u |
| Formula |
C26H20Cl3N5OS |
| InChI |
InChI=1S/C26H20Cl3N5OS/c1-15-22(24(35)31-21-12-10-20(29)11-13-21)23(17-4-8-19(28)9-5-17)34-25(30-15)32-26(33-34)36-14-16-2-6-18(27)7-3-16/h2-13,23H,14H2,1H3,(H,31,35)(H,30,32,33) |
| InChIKey |
LLHHIXHNSZRMOB-UHFFFAOYSA-N |
| Molecular Weight |
556.899 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_6693 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12329009 |
![2-[(4-chlorobenzyl)sulfanyl]-N,7-bis(4-chlorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide](/api/spectrum/5KRMBK9x0y2/structure.png?h=300&w=458 "2-[(4-chlorobenzyl)sulfanyl]-N,7-bis(4-chlorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide")
