N-((E)-{5-[(3-chlorophenoxy)methyl]-2-furyl}methylidene)-3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine

SpectraBase Compound ID	DeOPyRzbcdC
InChI	InChI=1S/C16H13ClF2N4O2S/c1-26-16-22-21-15(14(18)19)23(16)20-8-12-5-6-13(25-12)9-24-11-4-2-3-10(17)7-11/h2-8,14H,9H2,1H3/b20-8+
InChIKey	IBOWBRXTKGXSAL-DNTJNYDQSA-N Google Search
Mol Weight	398.82 g/mol
Molecular Formula	C16H13ClF2N4O2S
Exact Mass	398.041581 g/mol

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SpectraBase Spectrum ID	1N1cMnpIwKg
Name	N-((E)-{5-[(3-chlorophenoxy)methyl]-2-furyl}methylidene)-3-(difluoromethyl)-5-(methylsulfanyl)-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/C16H13ClF2N4O2S/c1-26-16-22-21-15(14(18)19)23(16)20-8-12-5-6-13(25-12)9-24-11-4-2-3-10(17)7-11/h2-8,14H,9H2,1H3/b20-8+
InChIKey	IBOWBRXTKGXSAL-DNTJNYDQSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_29819
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: 1286906; SBI_ID: SBI-029823
Synonyms	N-((E)-{5-[(3-chlorophenoxy)methyl]-2-furyl}methylidene)-N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]amineN-({5-[(3-chlorophenoxy)methyl]-2-furyl}methylidene)-3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine
Temperature	308 °C