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4-bromo-N'-{(E)-[3-({[4-(difluoromethyl)-6-methyl-2-pyrimidinyl]sulfanyl}methyl)-4-methoxyphenyl]methylidene}benzenesulfonohydrazide
SpectraBase Compound ID 8E1Aj4quuwk
InChI InChI=1S/C21H19BrF2N4O3S2/c1-13-9-18(20(23)24)27-21(26-13)32-12-15-10-14(3-8-19(15)31-2)11-25-28-33(29,30)17-6-4-16(22)5-7-17/h3-11,20,28H,12H2,1-2H3/b25-11+
InChIKey ODOBSHRFJXXBQB-OPEKNORGSA-N
Mol Weight 557.43 g/mol
Molecular Formula C21H19BrF2N4O3S2
Exact Mass 556.005002 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3R9rEoPLdwn
Name 4-bromo-N'-{(E)-[3-({[4-(difluoromethyl)-6-methyl-2-pyrimidinyl]sulfanyl}methyl)-4-methoxyphenyl]methylidene}benzenesulfonohydrazide
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/C21H19BrF2N4O3S2/c1-13-9-18(20(23)24)27-21(26-13)32-12-15-10-14(3-8-19(15)31-2)11-25-28-33(29,30)17-6-4-16(22)5-7-17/h3-11,20,28H,12H2,1-2H3/b25-11+
InChIKey ODOBSHRFJXXBQB-OPEKNORGSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3992
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/9129474; Labnumber: BAL_UHYK/003607; UZI_ID: UZI-003994
Synonyms 4-bromo-N'-{[3-({[4-(difluoromethyl)-6-methyl-2-pyrimidinyl]sulfanyl}methyl)-4-methoxyphenyl]methylidene}benzenesulfonohydrazide
Temperature 318 °C