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N-(2-ethoxyphenyl)-2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID AvN2sRzpvWd
InChI InChI=1S/C23H21N5O2S/c1-2-30-20-13-7-6-12-19(20)25-21(29)16-31-23-27-26-22(17-9-8-14-24-15-17)28(23)18-10-4-3-5-11-18/h3-15H,2,16H2,1H3,(H,25,29)
InChIKey LYMREELLSPKIDR-UHFFFAOYSA-N
Mol Weight 431.51 g/mol
Molecular Formula C23H21N5O2S
Exact Mass 431.141596 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AL9jDQ49uNf
Name N-(2-ethoxyphenyl)-2-{[4-phenyl-5-(3-pyridinyl)-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/C23H21N5O2S/c1-2-30-20-13-7-6-12-19(20)25-21(29)16-31-23-27-26-22(17-9-8-14-24-15-17)28(23)18-10-4-3-5-11-18/h3-15H,2,16H2,1H3,(H,25,29)
InChIKey LYMREELLSPKIDR-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27357
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: D76276; Labnumber: MOR-8621; SBI_ID: SBI-027361
Temperature 315 °C