SpectraBase Spectrum ID |
1GUDpCdNmle |
Name |
ethanone, 2-[[5-[[(4-chlorophenyl)amino]methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-1-(4-methylphenyl)- |
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/C25H23ClN4OS/c1-17-7-9-19(10-8-17)23(31)16-32-25-29-28-24(15-27-21-13-11-20(26)12-14-21)30(25)22-6-4-3-5-18(22)2/h3-14,27H,15-16H2,1-2H3 |
InChIKey |
ATCCQROVVGXCIR-UHFFFAOYSA-N |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Origin |
1H_CB_8313_6857 |
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: NMR/10321064; Labnumber: DEM-0000181 |