| SpectraBase Spectrum ID |
IKcXmIkQxVw |
| Name |
ethyl 4-{[({4-(2-furylmethyl)-5-[(2-methyl-1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
529.178375539 u |
| Formula |
C28H27N5O4S |
| InChI |
InChI=1S/C28H27N5O4S/c1-3-36-27(35)19-10-12-20(13-11-19)30-26(34)17-38-28-32-31-25(33(28)16-21-7-6-14-37-21)15-23-18(2)29-24-9-5-4-8-22(23)24/h4-14,29H,3,15-17H2,1-2H3,(H,30,34) |
| InChIKey |
FHLCQWDHTMDFBZ-UHFFFAOYSA-N |
| Molecular Weight |
529.615 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_5897 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12319417 |
![ethyl 4-{[({4-(2-furylmethyl)-5-[(2-methyl-1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate](/api/spectrum/IKcXmIkQxVw/structure.png?h=300&w=458 "ethyl 4-{[({4-(2-furylmethyl)-5-[(2-methyl-1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate")
