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

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2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide
SpectraBase Compound ID 4t8Jfms6CRs
InChI InChI=1S/C20H21ClN4OS/c1-4-25-19(15-6-5-7-16(21)11-15)23-24-20(25)27-12-18(26)22-17-10-13(2)8-9-14(17)3/h5-11H,4,12H2,1-3H3,(H,22,26)
InChIKey YEVMBWMSNMKEPJ-UHFFFAOYSA-N
Mol Weight 400.93 g/mol
Molecular Formula C20H21ClN4OS
Exact Mass 400.11246 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A1pVvrR6LWZ
Name 2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)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/C20H21ClN4OS/c1-4-25-19(15-6-5-7-16(21)11-15)23-24-20(25)27-12-18(26)22-17-10-13(2)8-9-14(17)3/h5-11H,4,12H2,1-3H3,(H,22,26)
InChIKey YEVMBWMSNMKEPJ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11131
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: E06129; Labnumber: GRES-16561; SBI_ID: SBI-011134
Temperature 306 °C