| SpectraBase Spectrum ID |
fLdf9cF2O |
| Name |
2-chloro-5-[({[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 © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C16H13ClN6O3S/c1-23-14(12-7-18-4-5-19-12)21-22-16(23)27-8-13(24)20-9-2-3-11(17)10(6-9)15(25)26/h2-7H,8H2,1H3,(H,20,24)(H,25,26) |
| InChIKey |
FRJYFDFCGMRKJN-UHFFFAOYSA-N |
| NMR Offset |
15.449 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_35840 |
| 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: E94395; SBI_ID: SBI-035844 |
| Temperature |
308 °C |
![2-chloro-5-[({[4-methyl-5-(2-pyrazinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid](/api/spectrum/fLdf9cF2O/structure.png?h=300&w=458 "2-chloro-5-[({[4-methyl-5-(2-pyrazinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid")
