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

SpectraBase Compound ID	GnEndkY2MO2
InChI	InChI=1S/C19H15Cl3N4OS/c1-2-7-26-18(12-3-5-13(20)6-4-12)24-25-19(26)28-11-17(27)23-16-9-14(21)8-15(22)10-16/h2-6,8-10H,1,7,11H2,(H,23,27)
InChIKey	BQPXBLOBRXRIKC-UHFFFAOYSA-N Google Search
Mol Weight	453.78 g/mol
Molecular Formula	C19H15Cl3N4OS
Exact Mass	452.003215 g/mol

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SpectraBase Spectrum ID	BfVBSyjiijG
Name	2-{[4-allyl-5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dichlorophenyl)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/C19H15Cl3N4OS/c1-2-7-26-18(12-3-5-13(20)6-4-12)24-25-19(26)28-11-17(27)23-16-9-14(21)8-15(22)10-16/h2-6,8-10H,1,7,11H2,(H,23,27)
InChIKey	BQPXBLOBRXRIKC-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_4055
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: D98484; Labnumber: GRES-21695; SBI_ID: SBI-004057
Temperature	308 °C