2-furancarboxamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl]methyl]-

SpectraBase Compound ID	KqzggHUBKTJ
InChI	InChI=1S/C31H25F3N6O3S2/c1-19-9-11-20(12-10-19)24-16-23(26-8-4-14-44-26)38-40(24)28(41)18-45-30-37-36-27(17-35-29(42)25-7-3-13-43-25)39(30)22-6-2-5-21(15-22)31(32,33)34/h2-15,24H,16-18H2,1H3,(H,35,42)
InChIKey	NDYQWGJYVQSEEJ-UHFFFAOYSA-N Google Search
Mol Weight	650.7 g/mol
Molecular Formula	C31H25F3N6O3S2
Exact Mass	650.138166 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	640KC9AM3uN
Name	2-furancarboxamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl]methyl]-
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/C31H25F3N6O3S2/c1-19-9-11-20(12-10-19)24-16-23(26-8-4-14-44-26)38-40(24)28(41)18-45-30-37-36-27(17-35-29(42)25-7-3-13-43-25)39(30)22-6-2-5-21(15-22)31(32,33)34/h2-15,24H,16-18H2,1H3,(H,35,42)
InChIKey	NDYQWGJYVQSEEJ-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_5463
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/10257118; Labnumber: F0514-4515