SpectraBase Spectrum ID |
EhIIW1q7NxR |
Name |
benzamide, N-[[4-(3-chlorophenyl)-5-[[2-[5-(2,3-dimethoxyphenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4H-1,2,4-triazol-3-yl]methyl]-3-fluoro- |
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/C33H28ClFN6O4S2/c1-44-27-12-5-11-24(31(27)45-2)26-17-25(28-13-6-14-46-28)39-41(26)30(42)19-47-33-38-37-29(40(33)23-10-4-8-21(34)16-23)18-36-32(43)20-7-3-9-22(35)15-20/h3-16,26H,17-19H2,1-2H3,(H,36,43) |
InChIKey |
NGZPSHHTYIQIFG-UHFFFAOYSA-N |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Origin |
1H_CB_8313_5498 |
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/10257162; Labnumber: F0514-0456 |