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N-(3-chloro-4-fluorophenyl)-2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 8jPsljzNKpm
InChI InChI=1S/C17H18ClFN6OS/c1-4-25-16(14-7-10(2)24(3)23-14)21-22-17(25)27-9-15(26)20-11-5-6-13(19)12(18)8-11/h5-8H,4,9H2,1-3H3,(H,20,26)
InChIKey QYPLNXUULNGUSQ-UHFFFAOYSA-N
Mol Weight 408.88 g/mol
Molecular Formula C17H18ClFN6OS
Exact Mass 408.093536 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Da0cRKQvXn
Name N-(3-chloro-4-fluorophenyl)-2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-ethyl-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/C17H18ClFN6OS/c1-4-25-16(14-7-10(2)24(3)23-14)21-22-17(25)27-9-15(26)20-11-5-6-13(19)12(18)8-11/h5-8H,4,9H2,1-3H3,(H,20,26)
InChIKey QYPLNXUULNGUSQ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10606
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: UZI/1264901; Labnumber: KUZ0468; UZI_ID: UZI-010608
Temperature 308 °C