| SpectraBase Spectrum ID |
LFBIc4mrWY2 |
| Name |
2-{[4-allyl-5-(2-quinolinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-nitrophenyl)acetamide |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
446.116109635 u |
| Formula |
C22H18N6O3S |
| InChI |
InChI=1S/C22H18N6O3S/c1-2-12-27-21(19-11-10-15-6-3-4-9-18(15)24-19)25-26-22(27)32-14-20(29)23-16-7-5-8-17(13-16)28(30)31/h2-11,13H,1,12,14H2,(H,23,29) |
| InChIKey |
ASLJZALRPNDJIP-UHFFFAOYSA-N |
| Molecular Weight |
446.485 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_1255 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12269417 |
![2-{[4-allyl-5-(2-quinolinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-nitrophenyl)acetamide](/api/spectrum/LFBIc4mrWY2/structure.png?h=300&w=458 "2-{[4-allyl-5-(2-quinolinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-nitrophenyl)acetamide")
