3-chloro-N-[1-(3,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1-benzothiophene-2-carboxamide

SpectraBase Compound ID	I8BauWvKJHZ
InChI	InChI=1S/C21H16Cl3N3OS/c1-11-19(12(2)27(26-11)10-13-7-8-15(22)16(23)9-13)25-21(28)20-18(24)14-5-3-4-6-17(14)29-20/h3-9H,10H2,1-2H3,(H,25,28)
InChIKey	XYRIATIHLAETKO-UHFFFAOYSA-N Google Search
Mol Weight	464.8 g/mol
Molecular Formula	C21H16Cl3N3OS
Exact Mass	463.007966 g/mol

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SpectraBase Spectrum ID	4VHie7lOQyZ
Name	3-chloro-N-[1-(3,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1-benzothiophene-2-carboxamide
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/C21H16Cl3N3OS/c1-11-19(12(2)27(26-11)10-13-7-8-15(22)16(23)9-13)25-21(28)20-18(24)14-5-3-4-6-17(14)29-20/h3-9H,10H2,1-2H3,(H,25,28)
InChIKey	XYRIATIHLAETKO-UHFFFAOYSA-N
NMR Offset	16.0772
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_1742
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: 9288877; UBI_ID: UBI-001743
Temperature	308 °C