benzamide, N-[[5-[[2-[5-(2,3-dimethoxyphenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]methyl]-3-fluoro-

SpectraBase Compound ID	ItsPTITzLtx
InChI	InChI=1S/C35H33FN6O5S2/c1-4-47-25-15-13-24(14-16-25)41-31(20-37-34(44)22-8-5-9-23(36)18-22)38-39-35(41)49-21-32(43)42-28(19-27(40-42)30-12-7-17-48-30)26-10-6-11-29(45-2)33(26)46-3/h5-18,28H,4,19-21H2,1-3H3,(H,37,44)
InChIKey	UKAQKITYXHJHPA-UHFFFAOYSA-N Google Search
Mol Weight	700.8 g/mol
Molecular Formula	C35H33FN6O5S2
Exact Mass	700.193789 g/mol

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SpectraBase Spectrum ID	2y5pfZzt9Xv
Name	benzamide, N-[[5-[[2-[5-(2,3-dimethoxyphenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(4-ethoxyphenyl)-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/C35H33FN6O5S2/c1-4-47-25-15-13-24(14-16-25)41-31(20-37-34(44)22-8-5-9-23(36)18-22)38-39-35(41)49-21-32(43)42-28(19-27(40-42)30-12-7-17-48-30)26-10-6-11-29(45-2)33(26)46-3/h5-18,28H,4,19-21H2,1-3H3,(H,37,44)
InChIKey	UKAQKITYXHJHPA-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_5501
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/10257169; Labnumber: F0514-0564