| SpectraBase Spectrum ID |
DC91LSgaUEO |
| Name |
2-({4-allyl-5-[(2-methyl-1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-fluorobenzyl)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 |
449.168559749 u |
| Formula |
C24H24FN5OS |
| InChI |
InChI=1S/C24H24FN5OS/c1-3-12-30-22(13-20-16(2)27-21-7-5-4-6-19(20)21)28-29-24(30)32-15-23(31)26-14-17-8-10-18(25)11-9-17/h3-11,27H,1,12-15H2,2H3,(H,26,31) |
| InChIKey |
DOICUNHUJXJPGU-UHFFFAOYSA-N |
| Molecular Weight |
449.548 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_4480 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12309423 |
![2-({4-allyl-5-[(2-methyl-1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-fluorobenzyl)acetamide](/api/spectrum/DC91LSgaUEO/structure.png?h=300&w=458 "2-({4-allyl-5-[(2-methyl-1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-fluorobenzyl)acetamide")
