2-{[4-allyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide

SpectraBase Compound ID	FcPH9fI9zCk
InChI	InChI=1S/C20H18F2N4O2S/c1-3-10-26-19(13-4-7-15(28-2)8-5-13)24-25-20(26)29-12-18(27)23-14-6-9-16(21)17(22)11-14/h3-9,11H,1,10,12H2,2H3,(H,23,27)
InChIKey	AWYHJWHFFLLBGG-UHFFFAOYSA-N Google Search
Mol Weight	416.45 g/mol
Molecular Formula	C20H18F2N4O2S
Exact Mass	416.111853 g/mol

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SpectraBase Spectrum ID	Fb0Suk9CysU
Name	2-{[4-allyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide
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/C20H18F2N4O2S/c1-3-10-26-19(13-4-7-15(28-2)8-5-13)24-25-20(26)29-12-18(27)23-14-6-9-16(21)17(22)11-14/h3-9,11H,1,10,12H2,2H3,(H,23,27)
InChIKey	AWYHJWHFFLLBGG-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_14318
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: D98179; Labnumber: GRES-16882; SBI_ID: SBI-014321
Temperature	318 °C