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(5E)-2-[4-(3-methylphenyl)-1-piperazinyl]-5-({5-[3-(trifluoromethyl)phenyl]-2-furyl}methylene)-1,3-thiazol-4(5H)-one
SpectraBase Compound ID 3buf2nePkpH
InChI InChI=1S/C26H22F3N3O2S/c1-17-4-2-7-20(14-17)31-10-12-32(13-11-31)25-30-24(33)23(35-25)16-21-8-9-22(34-21)18-5-3-6-19(15-18)26(27,28)29/h2-9,14-16H,10-13H2,1H3/b23-16+
InChIKey QNUYYOWEXFFADV-XQNSMLJCSA-N
Mol Weight 497.54 g/mol
Molecular Formula C26H22F3N3O2S
Exact Mass 497.138483 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HAFXYAX6I4P
Name (5E)-2-[4-(3-methylphenyl)-1-piperazinyl]-5-({5-[3-(trifluoromethyl)phenyl]-2-furyl}methylene)-1,3-thiazol-4(5H)-one
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/C26H22F3N3O2S/c1-17-4-2-7-20(14-17)31-10-12-32(13-11-31)25-30-24(33)23(35-25)16-21-8-9-22(34-21)18-5-3-6-19(15-18)26(27,28)29/h2-9,14-16H,10-13H2,1H3/b23-16+
InChIKey QNUYYOWEXFFADV-XQNSMLJCSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12366
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: D71857; Labnumber: VLMK0448; SBI_ID: SBI-012369
Synonyms 2-[4-(3-methylphenyl)-1-piperazinyl]-5-({5-[3-(trifluoromethyl)phenyl]-2-furyl}methylene)-1,3-thiazol-4(5H)-one
Temperature 304 °C