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N-(3-chloro-4-methoxyphenyl)-2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

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N-(3-chloro-4-methoxyphenyl)-2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 5FUjuPsazSn
InChI InChI=1S/C20H21ClN4O2S/c1-4-25-19(14-7-5-13(2)6-8-14)23-24-20(25)28-12-18(26)22-15-9-10-17(27-3)16(21)11-15/h5-11H,4,12H2,1-3H3,(H,22,26)
InChIKey QVAJRSRKQBFBCB-UHFFFAOYSA-N
Mol Weight 416.93 g/mol
Molecular Formula C20H21ClN4O2S
Exact Mass 416.107375 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4CutYGIiYF
Name N-(3-chloro-4-methoxyphenyl)-2-{[4-ethyl-5-(4-methylphenyl)-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/C20H21ClN4O2S/c1-4-25-19(14-7-5-13(2)6-8-14)23-24-20(25)28-12-18(26)22-15-9-10-17(27-3)16(21)11-15/h5-11H,4,12H2,1-3H3,(H,22,26)
InChIKey QVAJRSRKQBFBCB-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4031
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: D98436; Labnumber: GRES-20955; SBI_ID: SBI-004033
Temperature 308 °C