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2-(1,3-benzoxazol-2-ylsulfanyl)-N'-{(E)-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}acetohydrazide
SpectraBase Compound ID CMYzuPugCST
InChI InChI=1S/C22H19FN4O2S/c1-14-11-16(15(2)27(14)18-9-7-17(23)8-10-18)12-24-26-21(28)13-30-22-25-19-5-3-4-6-20(19)29-22/h3-12H,13H2,1-2H3,(H,26,28)/b24-12+
InChIKey MVLKVZIOZJWJKR-WYMPLXKRSA-N
Mol Weight 422.48 g/mol
Molecular Formula C22H19FN4O2S
Exact Mass 422.121275 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ChcJmnRgq35
Name 2-(1,3-benzoxazol-2-ylsulfanyl)-N'-{(E)-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}acetohydrazide
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/C22H19FN4O2S/c1-14-11-16(15(2)27(14)18-9-7-17(23)8-10-18)12-24-26-21(28)13-30-22-25-19-5-3-4-6-20(19)29-22/h3-12H,13H2,1-2H3,(H,26,28)/b24-12+
InChIKey MVLKVZIOZJWJKR-WYMPLXKRSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8208
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/1009136; UBI_ID: UBI-008211
Synonyms 2-(1,3-benzoxazol-2-ylsulfanyl)-N'-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}acetohydrazide
Temperature 308 °C