5-[(3-chloro-2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl hydrosulfide

SpectraBase Compound ID	G3kzGTZunVF
InChI	InChI=1S/C16H15ClN4S/c1-11-13(17)8-5-9-14(11)18-10-15-19-20-16(22)21(15)12-6-3-2-4-7-12/h2-9,18H,10H2,1H3,(H,20,22)
InChIKey	NTAMWTGWQVIDPR-UHFFFAOYSA-N Google Search
Mol Weight	330.84 g/mol
Molecular Formula	C16H15ClN4S
Exact Mass	330.070595 g/mol

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SpectraBase Spectrum ID	KUAo7xZvW5P
Name	5-[(3-chloro-2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl hydrosulfide
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/C16H15ClN4S/c1-11-13(17)8-5-9-14(11)18-10-15-19-20-16(22)21(15)12-6-3-2-4-7-12/h2-9,18H,10H2,1H3,(H,20,22)
InChIKey	NTAMWTGWQVIDPR-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_6696
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: NMR/11261918; Labnumber: 1496; IOH_ID: IOH-006697
Synonyms	5-[(3-chloro-2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol