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(4E)-4-[(4-fluoroanilino)methylene]-2-phenyl-5-{[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one

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(4E)-4-[(4-fluoroanilino)methylene]-2-phenyl-5-{[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID GGeNzasJzyx
InChI InChI=1S/C24H18FN7OS/c25-17-11-13-18(14-12-17)26-15-21-22(28-31(23(21)33)19-7-3-1-4-8-19)16-34-24-27-29-30-32(24)20-9-5-2-6-10-20/h1-15,26H,16H2/b21-15+
InChIKey SECPLYWXFSFWCQ-RCCKNPSSSA-N
Mol Weight 471.51 g/mol
Molecular Formula C24H18FN7OS
Exact Mass 471.127758 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BfBPAFqebfh
Name (4E)-4-[(4-fluoroanilino)methylene]-2-phenyl-5-{[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
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/C24H18FN7OS/c25-17-11-13-18(14-12-17)26-15-21-22(28-31(23(21)33)19-7-3-1-4-8-19)16-34-24-27-29-30-32(24)20-9-5-2-6-10-20/h1-15,26H,16H2/b21-15+
InChIKey SECPLYWXFSFWCQ-RCCKNPSSSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13823
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: D91320; Labnumber: VGU-30858; SBI_ID: SBI-013826
Synonyms 4-[(4-fluoroanilino)methylene]-2-phenyl-5-{[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Temperature 318 °C