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N-{1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}acetamide

View entire compound with spectra: 1 NMR

N-{1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}acetamide
SpectraBase Compound ID IV0a44pUHgi
InChI InChI=1S/C22H24F3N9OS/c1-5-33-11-17(14(3)31-33)18-6-19(22(23,24)25)29-21(28-18)36-12-20(35)27-16-7-26-34(10-16)9-15-8-32(4)30-13(15)2/h6-8,10-11H,5,9,12H2,1-4H3,(H,27,35)
InChIKey VUEQNHOZTRKPFV-UHFFFAOYSA-N
Mol Weight 519.55 g/mol
Molecular Formula C22H24F3N9OS
Exact Mass 519.177662 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9za1O3Eoy5o
Name N-{1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}acetamide
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/C22H24F3N9OS/c1-5-33-11-17(14(3)31-33)18-6-19(22(23,24)25)29-21(28-18)36-12-20(35)27-16-7-26-34(10-16)9-15-8-32(4)30-13(15)2/h6-8,10-11H,5,9,12H2,1-4H3,(H,27,35)
InChIKey VUEQNHOZTRKPFV-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32330
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: 1847523; SBI_ID: SBI-032334
Temperature 315 °C