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N-(3-chloro-4-fluorophenyl)-2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 1cISKeeq9HY
InChI InChI=1S/C24H19Cl2FN4O2S/c1-2-33-17-10-8-16(9-11-17)31-23(18-5-3-4-6-19(18)25)29-30-24(31)34-14-22(32)28-15-7-12-21(27)20(26)13-15/h3-13H,2,14H2,1H3,(H,28,32)
InChIKey WCMRPILJHBOJAF-UHFFFAOYSA-N
Mol Weight 517.41 g/mol
Molecular Formula C24H19Cl2FN4O2S
Exact Mass 516.058981 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1EDSjUY7vq1
Name N-(3-chloro-4-fluorophenyl)-2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]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/C24H19Cl2FN4O2S/c1-2-33-17-10-8-16(9-11-17)31-23(18-5-3-4-6-19(18)25)29-30-24(31)34-14-22(32)28-15-7-12-21(27)20(26)13-15/h3-13H,2,14H2,1H3,(H,28,32)
InChIKey WCMRPILJHBOJAF-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4921
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: E08371; Labnumber: GRES-36980; SBI_ID: SBI-004923
Temperature 308 °C