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

SpectraBase Compound ID	7ijAVWUM5wB
InChI	InChI=1S/C34H31FN6O3S2/c1-44-27-14-12-24(13-15-27)29-20-28(30-11-6-18-45-30)39-41(29)32(42)22-46-34-38-37-31(40(34)17-16-23-7-3-2-4-8-23)21-36-33(43)25-9-5-10-26(35)19-25/h2-15,18-19,29H,16-17,20-22H2,1H3,(H,36,43)
InChIKey	KKGRWKNAXCDTHH-UHFFFAOYSA-N Google Search
Mol Weight	654.8 g/mol
Molecular Formula	C34H31FN6O3S2
Exact Mass	654.188309 g/mol

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SpectraBase Spectrum ID	5CUCMTTfWel
Name	benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methoxyphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(2-phenylethyl)-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/C34H31FN6O3S2/c1-44-27-14-12-24(13-15-27)29-20-28(30-11-6-18-45-30)39-41(29)32(42)22-46-34-38-37-31(40(34)17-16-23-7-3-2-4-8-23)21-36-33(43)25-9-5-10-26(35)19-25/h2-15,18-19,29H,16-17,20-22H2,1H3,(H,36,43)
InChIKey	KKGRWKNAXCDTHH-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_5567
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/10257266; Labnumber: F0514-4954