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

SpectraBase Compound ID	Jt9UMXOXzx0
InChI	InChI=1S/C16H12ClN5O2S/c1-10-3-2-4-12(7-10)15-19-20-16(25)21(15)18-9-11-5-6-13(17)14(8-11)22(23)24/h2-9H,1H3,(H,20,25)/b18-9+
InChIKey	WKMXFBXEHOVTBP-GIJQJNRQSA-N Google Search
Mol Weight	373.82 g/mol
Molecular Formula	C16H12ClN5O2S
Exact Mass	373.040024 g/mol

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SpectraBase Spectrum ID	7up0r1WLVxD
Name	4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-5-(3-methylphenyl)-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/C16H12ClN5O2S/c1-10-3-2-4-12(7-10)15-19-20-16(25)21(15)18-9-11-5-6-13(17)14(8-11)22(23)24/h2-9H,1H3,(H,20,25)/b18-9+
InChIKey	WKMXFBXEHOVTBP-GIJQJNRQSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_5427
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: D25106; Labnumber: GRES-03136; SBI_ID: SBI-005429
Synonyms	4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(4-chloro-3-nitrophenyl)methylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Temperature	318 °C