2-[2-bromo-6-methoxy-4-((Z)-{3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-4H-pyrazol-4-ylidene}methyl)phenoxy]-N-(4-methylphenyl)acetamide

SpectraBase Compound ID	ITW9SIxnEQP
InChI	InChI=1S/C28H23BrF3N3O4/c1-16-7-9-20(10-8-16)33-25(36)15-39-26-23(29)12-18(13-24(26)38-3)11-22-17(2)34-35(27(22)37)21-6-4-5-19(14-21)28(30,31)32/h4-14H,15H2,1-3H3,(H,33,36)/b22-11-
InChIKey	QOFZJYPSWIPFCY-JJFYIABZSA-N Google Search
Mol Weight	602.41 g/mol
Molecular Formula	C28H23BrF3N3O4
Exact Mass	601.082404 g/mol

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SpectraBase Spectrum ID	9jKS567H7Q2
Name	2-[2-bromo-6-methoxy-4-((Z)-{3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-4H-pyrazol-4-ylidene}methyl)phenoxy]-N-(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/C28H23BrF3N3O4/c1-16-7-9-20(10-8-16)33-25(36)15-39-26-23(29)12-18(13-24(26)38-3)11-22-17(2)34-35(27(22)37)21-6-4-5-19(14-21)28(30,31)32/h4-14H,15H2,1-3H3,(H,33,36)/b22-11-
InChIKey	QOFZJYPSWIPFCY-JJFYIABZSA-N
NMR Offset	14.9921
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_7049
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: UZI/8189981; UBI_ID: UBI-007052
Synonyms	2-[2-bromo-6-methoxy-4-({3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-4H-pyrazol-4-ylidene}methyl)phenoxy]-N-(4-methylphenyl)acetamide
Temperature	313 °C