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4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 6lVHWnbGZbw
InChI InChI=1S/C16H15N5O2S/c1-22-13-8-5-6-11(14(13)23-2)10-18-21-15(19-20-16(21)24)12-7-3-4-9-17-12/h3-10H,1-2H3,(H,20,24)/b18-10+
InChIKey CNCDBWCIQHDLAR-VCHYOVAHSA-N
Mol Weight 341.39 g/mol
Molecular Formula C16H15N5O2S
Exact Mass 341.094646 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AtM7Rcmlb2M
Name 4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(2-pyridinyl)-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/C16H15N5O2S/c1-22-13-8-5-6-11(14(13)23-2)10-18-21-15(19-20-16(21)24)12-7-3-4-9-17-12/h3-10H,1-2H3,(H,20,24)/b18-10+
InChIKey CNCDBWCIQHDLAR-VCHYOVAHSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16747
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: D24804; Labnumber: GRES-02810; SBI_ID: SBI-016750
Synonyms 4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(2-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(2,3-dimethoxyphenyl)methylidene]amino}-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol
Temperature 315 °C