4-(4-chlorophenyl)-3-[(2-fluorobenzyl)sulfanyl]-5-(3-methylphenyl)-4H-1,2,4-triazole

SpectraBase Compound ID	Bo8UrbWsFtn
InChI	InChI=1S/C22H17ClFN3S/c1-15-5-4-7-16(13-15)21-25-26-22(27(21)19-11-9-18(23)10-12-19)28-14-17-6-2-3-8-20(17)24/h2-13H,14H2,1H3
InChIKey	MAQDLUKORCSNGB-UHFFFAOYSA-N Google Search
Mol Weight	409.91 g/mol
Molecular Formula	C22H17ClFN3S
Exact Mass	409.081575 g/mol

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SpectraBase Spectrum ID	76fKvMMzpcU
Name	4-(4-chlorophenyl)-3-[(2-fluorobenzyl)sulfanyl]-5-(3-methylphenyl)-4H-1,2,4-triazole
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/C22H17ClFN3S/c1-15-5-4-7-16(13-15)21-25-26-22(27(21)19-11-9-18(23)10-12-19)28-14-17-6-2-3-8-20(17)24/h2-13H,14H2,1H3
InChIKey	MAQDLUKORCSNGB-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_4869
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: E08283; Labnumber: GRES-36874; SBI_ID: SBI-004871
Synonyms	4-(4-chlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl 2-fluorobenzyl sulfide
Temperature	315 °C