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4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(2-quinolinyl)-4H-1,2,4-triazole-3-thiol

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4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(2-quinolinyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID JOs5vfpEChu
InChI InChI=1S/C19H14N4O2S/c26-19-22-21-18(15-7-5-12-3-1-2-4-14(12)20-15)23(19)13-6-8-16-17(11-13)25-10-9-24-16/h1-8,11H,9-10H2,(H,22,26)
InChIKey IVODDBAZEHPKAK-UHFFFAOYSA-N
Mol Weight 362.41 g/mol
Molecular Formula C19H14N4O2S
Exact Mass 362.083747 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JAnfWJNLz7d
Name 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(2-quinolinyl)-4H-1,2,4-triazole-3-thiol
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/C19H14N4O2S/c26-19-22-21-18(15-7-5-12-3-1-2-4-14(12)20-15)23(19)13-6-8-16-17(11-13)25-10-9-24-16/h1-8,11H,9-10H2,(H,22,26)
InChIKey IVODDBAZEHPKAK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_24523
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: D47587; Labnumber: NCOBK-0524; SBI_ID: SBI-024527
Synonyms 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(2-quinolinyl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 318 °C