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

View entire compound with spectra: 1 NMR

benzamide, 3-fluoro-N-[[5-[[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-phenyl-4H-1,2,4-triazol-3-yl]methyl]-
SpectraBase Compound ID KE63Bbi8tbV
InChI InChI=1S/C31H24F2N6O2S2/c32-22-13-11-20(12-14-22)26-17-25(27-10-5-15-42-27)37-39(26)29(40)19-43-31-36-35-28(38(31)24-8-2-1-3-9-24)18-34-30(41)21-6-4-7-23(33)16-21/h1-16,26H,17-19H2,(H,34,41)
InChIKey MMOZOGOKTZBKOK-UHFFFAOYSA-N
Mol Weight 614.69 g/mol
Molecular Formula C31H24F2N6O2S2
Exact Mass 614.137023 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8RDKMoNBrZu
Name benzamide, 3-fluoro-N-[[5-[[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-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/C31H24F2N6O2S2/c32-22-13-11-20(12-14-22)26-17-25(27-10-5-15-42-27)37-39(26)29(40)19-43-31-36-35-28(38(31)24-8-2-1-3-9-24)18-34-30(41)21-6-4-7-23(33)16-21/h1-16,26H,17-19H2,(H,34,41)
InChIKey MMOZOGOKTZBKOK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5493
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/10257157; Labnumber: F0514-0438