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2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethylphenyl)acetamide
SpectraBase Compound ID 4adUupzWQqH
InChI InChI=1S/C20H21ClN4OS/c1-3-14-8-5-6-11-17(14)22-18(26)13-27-20-24-23-19(25(20)4-2)15-9-7-10-16(21)12-15/h5-12H,3-4,13H2,1-2H3,(H,22,26)
InChIKey OLZWFJRWXBIOPF-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 4lHOoz7lG0U
Name 2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethylphenyl)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/c1-3-14-8-5-6-11-17(14)22-18(26)13-27-20-24-23-19(25(20)4-2)15-9-7-10-16(21)12-15/h5-12H,3-4,13H2,1-2H3,(H,22,26)
InChIKey OLZWFJRWXBIOPF-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11262
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: E06549; Labnumber: GRES-24532; SBI_ID: SBI-011265
Temperature 315 °C