| SpectraBase Spectrum ID |
LJTDHQAwObu |
| Name |
4-[({[4-methyl-5-(2-pyrazinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C16H14N6O3S/c1-22-14(12-8-17-6-7-18-12)20-21-16(22)26-9-13(23)19-11-4-2-10(3-5-11)15(24)25/h2-8H,9H2,1H3,(H,19,23)(H,24,25) |
| InChIKey |
XUCNDCXKHUYRSC-UHFFFAOYSA-N |
| NMR Offset |
15.449 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_35838 |
| 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: E94393; SBI_ID: SBI-035842 |
| Temperature |
308 °C |
![4-[({[4-methyl-5-(2-pyrazinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid](/api/spectrum/LJTDHQAwObu/structure.png?h=300&w=458 "4-[({[4-methyl-5-(2-pyrazinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid")
