N-[(E)-(2-bromophenyl)methylidene]-3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-amine

SpectraBase Compound ID	5BSdYls37ct
InChI	InChI=1S/C14H15BrF2N4S/c1-2-3-8-22-14-20-19-13(12(16)17)21(14)18-9-10-6-4-5-7-11(10)15/h4-7,9,12H,2-3,8H2,1H3/b18-9+
InChIKey	ZHJJTYDMLFTYAP-GIJQJNRQSA-N Google Search
Mol Weight	389.26 g/mol
Molecular Formula	C14H15BrF2N4S
Exact Mass	388.016887 g/mol

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SpectraBase Spectrum ID	8a8BYbJlzkh
Name	N-[(E)-(2-bromophenyl)methylidene]-3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-amine
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/C14H15BrF2N4S/c1-2-3-8-22-14-20-19-13(12(16)17)21(14)18-9-10-6-4-5-7-11(10)15/h4-7,9,12H,2-3,8H2,1H3/b18-9+
InChIKey	ZHJJTYDMLFTYAP-GIJQJNRQSA-N
NMR Offset	17.9118
NMR Spectrometer Frequency	500.077
Observed nucleus	1H
Origin	1H_SBI_36227_32234
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: 1844777; SBI_ID: SBI-032238
Synonyms	N-[(E)-(2-bromophenyl)methylidene]-N-[3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-yl]amineN-[(2-bromophenyl)methylidene]-3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-amine
Temperature	303 °C