SpectraBase Spectrum ID |
HqW7JZPqCHm |
Name |
benzoic acid, 2-[[[[4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]acetyl]amino]- |
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/C17H15N5O3S/c1-22-15(11-6-8-18-9-7-11)20-21-17(22)26-10-14(23)19-13-5-3-2-4-12(13)16(24)25/h2-9H,10H2,1H3,(H,19,23)(H,24,25) |
InChIKey |
YLOBSQHKZDJZCJ-UHFFFAOYSA-N |
NMR Offset |
15.5012 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_11628_6390 |
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: F28431; Labnumber: ALEKS1-29798 |