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4-{4-[2-(4-methylphenoxy)ethyl]-1-piperazinyl}-4-oxo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
SpectraBase Compound ID 3aaDUtEMuEe
InChI InChI=1S/C20H24F3N5O3S/c1-14-2-4-15(5-3-14)31-13-12-27-8-10-28(11-9-27)17(30)7-6-16(29)24-19-26-25-18(32-19)20(21,22)23/h2-5H,6-13H2,1H3,(H,24,26,29)
InChIKey LTMZOGUQMYKZDY-UHFFFAOYSA-N
Mol Weight 471.5 g/mol
Molecular Formula C20H24F3N5O3S
Exact Mass 471.155195 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1WmOX2pHBWi
Name 4-{4-[2-(4-methylphenoxy)ethyl]-1-piperazinyl}-4-oxo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
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/C20H24F3N5O3S/c1-14-2-4-15(5-3-14)31-13-12-27-8-10-28(11-9-27)17(30)7-6-16(29)24-19-26-25-18(32-19)20(21,22)23/h2-5H,6-13H2,1H3,(H,24,26,29)
InChIKey LTMZOGUQMYKZDY-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11573
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: E07196; Labnumber: GRESKO-7701; SBI_ID: SBI-011576
Temperature 306 °C