4-{[(E)-(4-bromophenyl)methylidene]amino}-5-(2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol

SpectraBase Compound ID	1moaJwF5Tlm
InChI	InChI=1S/C16H13BrN4OS/c1-22-14-5-3-2-4-13(14)15-19-20-16(23)21(15)18-10-11-6-8-12(17)9-7-11/h2-10H,1H3,(H,20,23)/b18-10+
InChIKey	DMGRFXJSGPCHCO-VCHYOVAHSA-N Google Search
Mol Weight	389.27 g/mol
Molecular Formula	C16H13BrN4OS
Exact Mass	387.999345 g/mol

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SpectraBase Spectrum ID	JgxuvrCZd5U
Name	4-{[(E)-(4-bromophenyl)methylidene]amino}-5-(2-methoxyphenyl)-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/C16H13BrN4OS/c1-22-14-5-3-2-4-13(14)15-19-20-16(23)21(15)18-10-11-6-8-12(17)9-7-11/h2-10H,1H3,(H,20,23)/b18-10+
InChIKey	DMGRFXJSGPCHCO-VCHYOVAHSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_16882
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: D25166; Labnumber: GRES-03206; SBI_ID: SBI-016885
Synonyms	4-{[(E)-(4-bromophenyl)methylidene]amino}-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(4-bromophenyl)methylidene]amino}-5-(2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Temperature	315 °C