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

View entire compound with spectra: 1 NMR

benzamide, N-[[4-(4-ethoxyphenyl)-5-[[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4H-1,2,4-triazol-3-yl]methyl]-3-methyl-
SpectraBase Compound ID 1Y56ZkUEHw6
InChI InChI=1S/C34H31FN6O3S2/c1-3-44-27-15-13-26(14-16-27)40-31(20-36-33(43)24-7-4-6-22(2)18-24)37-38-34(40)46-21-32(42)41-29(23-9-11-25(35)12-10-23)19-28(39-41)30-8-5-17-45-30/h4-18,29H,3,19-21H2,1-2H3,(H,36,43)
InChIKey HSFJKMJICGHMLA-UHFFFAOYSA-N
Mol Weight 654.8 g/mol
Molecular Formula C34H31FN6O3S2
Exact Mass 654.188309 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EDbZ3DcD7LJ
Name benzamide, N-[[4-(4-ethoxyphenyl)-5-[[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4H-1,2,4-triazol-3-yl]methyl]-3-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/C34H31FN6O3S2/c1-3-44-27-15-13-26(14-16-27)40-31(20-36-33(43)24-7-4-6-22(2)18-24)37-38-34(40)46-21-32(42)41-29(23-9-11-25(35)12-10-23)19-28(39-41)30-8-5-17-45-30/h4-18,29H,3,19-21H2,1-2H3,(H,36,43)
InChIKey HSFJKMJICGHMLA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5440
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/10257091; Labnumber: F0514-0270