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

View entire compound with spectra: 1 NMR

benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]methyl]-
SpectraBase Compound ID 6v5cV7ZNF6n
InChI InChI=1S/C32H27FN6O2S2/c1-21-9-11-22(12-10-21)27-18-26(28-8-5-17-42-28)37-39(27)30(40)20-43-32-36-35-29(38(32)25-15-13-24(33)14-16-25)19-34-31(41)23-6-3-2-4-7-23/h2-17,27H,18-20H2,1H3,(H,34,41)
InChIKey CRTNTMQBJVDBJW-UHFFFAOYSA-N
Mol Weight 610.7 g/mol
Molecular Formula C32H27FN6O2S2
Exact Mass 610.162095 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 36i2VOc6Alr
Name benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(4-fluorophenyl)-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/C32H27FN6O2S2/c1-21-9-11-22(12-10-21)27-18-26(28-8-5-17-42-28)37-39(27)30(40)20-43-32-36-35-29(38(32)25-15-13-24(33)14-16-25)19-34-31(41)23-6-3-2-4-7-23/h2-17,27H,18-20H2,1H3,(H,34,41)
InChIKey CRTNTMQBJVDBJW-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6081
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/10266672