SpectraBase Spectrum ID |
70WVH7lDhnR |
Name |
2-{[4-allyl-5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide |
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/C20H19ClN4O2S/c1-3-12-25-19(14-4-6-15(21)7-5-14)23-24-20(25)28-13-18(26)22-16-8-10-17(27-2)11-9-16/h3-11H,1,12-13H2,2H3,(H,22,26) |
InChIKey |
KCMDICNDNPZYNZ-UHFFFAOYSA-N |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_4345 |
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: D98854; Labnumber: GRES-27328; SBI_ID: SBI-004347 |
Temperature |
306 °C |