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

SpectraBase Compound ID	3YgBR1e8PZZ
InChI	InChI=1S/C15H18F2N4S/c1-3-4-9-22-15-20-19-14(13(16)17)21(15)18-10-12-8-6-5-7-11(12)2/h5-8,10,13H,3-4,9H2,1-2H3/b18-10+
InChIKey	BKIWJPWGLUPAJC-VCHYOVAHSA-N Google Search
Mol Weight	324.39 g/mol
Molecular Formula	C15H18F2N4S
Exact Mass	324.122024 g/mol

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SpectraBase Spectrum ID	6VvibE7fLsw
Name	3-(butylsulfanyl)-5-(difluoromethyl)-N-[(E)-(2-methylphenyl)methylidene]-4H-1,2,4-triazol-4-amine
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C15H18F2N4S/c1-3-4-9-22-15-20-19-14(13(16)17)21(15)18-10-12-8-6-5-7-11(12)2/h5-8,10,13H,3-4,9H2,1-2H3/b18-10+
InChIKey	BKIWJPWGLUPAJC-VCHYOVAHSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_32053
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: 1844516; SBI_ID: SBI-032057
Synonyms	N-[3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-yl]-N-[(E)-(2-methylphenyl)methylidene]amine3-(butylsulfanyl)-5-(difluoromethyl)-N-[(2-methylphenyl)methylidene]-4H-1,2,4-triazol-4-amine
Temperature	318 °C