| SpectraBase Spectrum ID |
5iQaMueBMP9 |
| Name |
4-[({[4-allyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C21H21N5O2S/c1-3-12-26-20(16-6-4-14(2)5-7-16)24-25-21(26)29-13-18(27)23-17-10-8-15(9-11-17)19(22)28/h3-11H,1,12-13H2,2H3,(H2,22,28)(H,23,27) |
| InChIKey |
VROFBOXFKGWWFE-UHFFFAOYSA-N |
| NMR Offset |
15.449 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_14555 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: D98688; Labnumber: GRES-24961; SBI_ID: SBI-014558 |
| Temperature |
308 °C |
![4-[({[4-allyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide](/api/spectrum/5iQaMueBMP9/structure.png?h=300&w=458 "4-[({[4-allyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide")
