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

SpectraBase Compound ID	9AizMnvh9AA
InChI	InChI=1S/C18H15ClN4S/c1-13-6-5-9-15(10-13)17-21-22-18(24)23(17)20-12-16(19)11-14-7-3-2-4-8-14/h2-12H,1H3,(H,22,24)/b16-11-,20-12+
InChIKey	DQRWTJDYYSGTIU-ULQIOQDBSA-N Google Search
Mol Weight	354.86 g/mol
Molecular Formula	C18H15ClN4S
Exact Mass	354.070595 g/mol

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SpectraBase Spectrum ID	25qUBIJpWST
Name	4-{[(E,2Z)-2-chloro-3-phenyl-2-propenylidene]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/C18H15ClN4S/c1-13-6-5-9-15(10-13)17-21-22-18(24)23(17)20-12-16(19)11-14-7-3-2-4-8-14/h2-12H,1H3,(H,22,24)/b16-11-,20-12+
InChIKey	DQRWTJDYYSGTIU-ULQIOQDBSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_16844
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: D25073; Labnumber: GRES-03100; SBI_ID: SBI-016847
Synonyms	4-{[(E,2Z)-2-chloro-3-phenyl-2-propenylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[2-chloro-3-phenyl-2-propenylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Temperature	315 °C