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

SpectraBase Compound ID	9vAot09HHyp
InChI	InChI=1S/C20H18ClFN4OS/c1-3-10-26-19(15-6-4-5-7-16(15)21)24-25-20(26)28-12-18(27)23-14-9-8-13(2)17(22)11-14/h3-9,11H,1,10,12H2,2H3,(H,23,27)
InChIKey	BQJSMKDQUPHKBY-UHFFFAOYSA-N Google Search
Mol Weight	416.9 g/mol
Molecular Formula	C20H18ClFN4OS
Exact Mass	416.087388 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	5Gw0PKbn5eU
Name	2-{[4-allyl-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)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/C20H18ClFN4OS/c1-3-10-26-19(15-6-4-5-7-16(15)21)24-25-20(26)28-12-18(27)23-14-9-8-13(2)17(22)11-14/h3-9,11H,1,10,12H2,2H3,(H,23,27)
InChIKey	BQJSMKDQUPHKBY-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_4518
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: D99087; Labnumber: GRES-31211; SBI_ID: SBI-004520
Temperature	315 °C