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2-{[4-allyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-pyridinyl)acetamide
SpectraBase Compound ID KmKai9KuBCl
InChI InChI=1S/C19H19N5O2S/c1-2-12-24-17(13-26-15-8-4-3-5-9-15)22-23-19(24)27-14-18(25)21-16-10-6-7-11-20-16/h2-11H,1,12-14H2,(H,20,21,25)
InChIKey SKAQUZXEFGIAGR-UHFFFAOYSA-N
Mol Weight 381.45 g/mol
Molecular Formula C19H19N5O2S
Exact Mass 381.125946 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 358k02h4wK8
Name 2-{[4-allyl-5-(phenoxymethyl)-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/C19H19N5O2S/c1-2-12-24-17(13-26-15-8-4-3-5-9-15)22-23-19(24)27-14-18(25)21-16-10-6-7-11-20-16/h2-11H,1,12-14H2,(H,20,21,25)
InChIKey SKAQUZXEFGIAGR-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16473
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/8121998; UBI_ID: UBI-016476
Temperature 313 °C