| SpectraBase Spectrum ID |
BOKQWsUk7mM |
| Name |
2-({4-allyl-5-[(2-methyl-1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethoxyphenyl)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 |
461.188546301 u |
| Formula |
C25H27N5O2S |
| InChI |
InChI=1S/C25H27N5O2S/c1-4-14-30-23(15-21-17(3)26-22-9-7-6-8-20(21)22)28-29-25(30)33-16-24(31)27-18-10-12-19(13-11-18)32-5-2/h4,6-13,26H,1,5,14-16H2,2-3H3,(H,27,31) |
| InChIKey |
TUXFFUIVHMIUDR-UHFFFAOYSA-N |
| Molecular Weight |
461.584 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_3197 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12288589 |
![2-({4-allyl-5-[(2-methyl-1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethoxyphenyl)acetamide](/api/spectrum/BOKQWsUk7mM/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-ethoxyphenyl)acetamide")
