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N-[5-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide
SpectraBase Compound ID mRUUgTMp2h
InChI InChI=1S/C20H17F3N4O2S2/c21-20(22,23)14-8-4-5-9-15(14)24-17(29)12-30-19-27-26-18(31-19)25-16(28)11-10-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,24,29)(H,25,26,28)
InChIKey MGQHNVCOBDEABA-UHFFFAOYSA-N
Mol Weight 466.5 g/mol
Molecular Formula C20H17F3N4O2S2
Exact Mass 466.074503 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BqkUe8E8PDA
Name N-[5-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide
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/C20H17F3N4O2S2/c21-20(22,23)14-8-4-5-9-15(14)24-17(29)12-30-19-27-26-18(31-19)25-16(28)11-10-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,24,29)(H,25,26,28)
InChIKey MGQHNVCOBDEABA-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21553
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: D55573; Labnumber: SPKOL-4427; SBI_ID: SBI-021557
Temperature 315 °C