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2-{[5-(4-bromo-5-ethyl-2-thienyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
SpectraBase Compound ID 9e8zYSs5Wz1
InChI InChI=1S/C20H23BrN4O2S2/c1-4-16-15(21)11-17(29-16)19-23-24-20(25(19)5-2)28-12-18(26)22-13-7-9-14(10-8-13)27-6-3/h7-11H,4-6,12H2,1-3H3,(H,22,26)
InChIKey KZOSBSCVQUNECT-UHFFFAOYSA-N
Mol Weight 495.45 g/mol
Molecular Formula C20H23BrN4O2S2
Exact Mass 494.044581 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8USzByNJAhi
Name 2-{[5-(4-bromo-5-ethyl-2-thienyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)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/C20H23BrN4O2S2/c1-4-16-15(21)11-17(29-16)19-23-24-20(25(19)5-2)28-12-18(26)22-13-7-9-14(10-8-13)27-6-3/h7-11H,4-6,12H2,1-3H3,(H,22,26)
InChIKey KZOSBSCVQUNECT-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6710
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/1265326; Labnumber: COL3287; UZI_ID: UZI-006712
Temperature 318 °C