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2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-pyridinyl)acetamide
SpectraBase Compound ID eWelFMpaPp
InChI InChI=1S/C20H16N6OS/c27-18(23-17-10-4-5-12-22-17)14-28-20-25-24-19(15-7-6-11-21-13-15)26(20)16-8-2-1-3-9-16/h1-13H,14H2,(H,22,23,27)
InChIKey FVODTDVWMUGIIZ-UHFFFAOYSA-N
Mol Weight 388.45 g/mol
Molecular Formula C20H16N6OS
Exact Mass 388.11063 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6lg1HUfDAPd
Name 2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-pyridinyl)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/C20H16N6OS/c27-18(23-17-10-4-5-12-22-17)14-28-20-25-24-19(15-7-6-11-21-13-15)26(20)16-8-2-1-3-9-16/h1-13H,14H2,(H,22,23,27)
InChIKey FVODTDVWMUGIIZ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7879
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: D48977; Labnumber: MOR-8594; SBI_ID: SBI-007882
Temperature 308 °C