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2-{[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridinyl]sulfanyl}-N-(5-methyl-3-isoxazolyl)acetamide
SpectraBase Compound ID LwEiOjflAy9
InChI InChI=1S/C25H20N4O3S/c1-16-12-23(29-32-16)28-24(30)15-33-25-21(14-26)20(17-8-10-19(31-2)11-9-17)13-22(27-25)18-6-4-3-5-7-18/h3-13H,15H2,1-2H3,(H,28,29,30)
InChIKey YBGIPSPZNZOEII-UHFFFAOYSA-N
Mol Weight 456.52 g/mol
Molecular Formula C25H20N4O3S
Exact Mass 456.125612 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3G0VoKuu37k
Name 2-{[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridinyl]sulfanyl}-N-(5-methyl-3-isoxazolyl)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/C25H20N4O3S/c1-16-12-23(29-32-16)28-24(30)15-33-25-21(14-26)20(17-8-10-19(31-2)11-9-17)13-22(27-25)18-6-4-3-5-7-18/h3-13H,15H2,1-2H3,(H,28,29,30)
InChIKey YBGIPSPZNZOEII-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10533
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: 132614; Labnumber: SHES1-173; VK_ID: VK-010537
Temperature 308 °C