5-[(3,4-dichloroanilino)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol

SpectraBase Compound ID	AcSzAoNhP63
InChI	InChI=1S/C15H12Cl2N4S/c16-12-7-6-10(8-13(12)17)18-9-14-19-20-15(22)21(14)11-4-2-1-3-5-11/h1-8,18H,9H2,(H,20,22)
InChIKey	XSPFUUGBCGSSHB-UHFFFAOYSA-N Google Search
Mol Weight	351.26 g/mol
Molecular Formula	C15H12Cl2N4S
Exact Mass	350.015973 g/mol

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SpectraBase Spectrum ID	5AzLjab8yFJ
Name	5-[(3,4-dichloroanilino)methyl]-4-phenyl-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/C15H12Cl2N4S/c16-12-7-6-10(8-13(12)17)18-9-14-19-20-15(22)21(14)11-4-2-1-3-5-11/h1-8,18H,9H2,(H,20,22)
InChIKey	XSPFUUGBCGSSHB-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_6682
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/11261903; Labnumber: 1480; IOH_ID: IOH-006683
Synonyms	5-[(3,4-dichloroanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl hydrosulfide