4-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol

SpectraBase Compound ID	GUqfKLHlnj0
InChI	InChI=1S/C14H9ClFN5S/c15-10-4-3-5-11(16)9(10)8-18-21-13(19-20-14(21)22)12-6-1-2-7-17-12/h1-8H,(H,20,22)/b18-8+
InChIKey	YWKIIQFCTUNCQO-QGMBQPNBSA-N Google Search
Mol Weight	333.77 g/mol
Molecular Formula	C14H9ClFN5S
Exact Mass	333.025122 g/mol

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SpectraBase Spectrum ID	4CaQetUbSQW
Name	4-{[(E)-(2-chloro-6-fluorophenyl)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/C14H9ClFN5S/c15-10-4-3-5-11(16)9(10)8-18-21-13(19-20-14(21)22)12-6-1-2-7-17-12/h1-8H,(H,20,22)/b18-8+
InChIKey	YWKIIQFCTUNCQO-QGMBQPNBSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_16746
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: D24802; Labnumber: GRES-02808; SBI_ID: SBI-016749
Synonyms	4-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5-(2-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(2-chloro-6-fluorophenyl)methylidene]amino}-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol
Temperature	315 °C