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acetamide, 2-[[8-(4-fluorophenyl)-3,4-dihydro-4-oxopyrazolo[1,5-a][1,3,5]triazin-2-yl]thio]-N-[(4-fluorophenyl)methyl]-
SpectraBase Compound ID 4F3uclSBlSx
InChI InChI=1S/C20H15F2N5O2S/c21-14-5-1-12(2-6-14)9-23-17(28)11-30-19-25-18-16(10-24-27(18)20(29)26-19)13-3-7-15(22)8-4-13/h1-8,10H,9,11H2,(H,23,28)(H,25,26,29)
InChIKey YPABUEMGMYFGQQ-UHFFFAOYSA-N
Mol Weight 427.43 g/mol
Molecular Formula C20H15F2N5O2S
Exact Mass 427.091452 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LuKkXkYuV6L
Name acetamide, 2-[[8-(4-fluorophenyl)-3,4-dihydro-4-oxopyrazolo[1,5-a][1,3,5]triazin-2-yl]thio]-N-[(4-fluorophenyl)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/C20H15F2N5O2S/c21-14-5-1-12(2-6-14)9-23-17(28)11-30-19-25-18-16(10-24-27(18)20(29)26-19)13-3-7-15(22)8-4-13/h1-8,10H,9,11H2,(H,23,28)(H,25,26,29)
InChIKey YPABUEMGMYFGQQ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_4742
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/16322297; Labnumber: DUD-701042