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N-{4-[({4-[(E)-2-(2-fluorophenyl)ethenyl]-2-pyrimidinyl}amino)sulfonyl]phenyl}-2-methylpropanamide
SpectraBase Compound ID 6RUoTEXzSkZ
InChI InChI=1S/C22H21FN4O3S/c1-15(2)21(28)25-17-9-11-19(12-10-17)31(29,30)27-22-24-14-13-18(26-22)8-7-16-5-3-4-6-20(16)23/h3-15H,1-2H3,(H,25,28)(H,24,26,27)/b8-7+
InChIKey SNJONJXOELWAGR-BQYQJAHWSA-N
Mol Weight 440.49 g/mol
Molecular Formula C22H21FN4O3S
Exact Mass 440.13184 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8qrVXhNsxX1
Name N-{4-[({4-[(E)-2-(2-fluorophenyl)ethenyl]-2-pyrimidinyl}amino)sulfonyl]phenyl}-2-methylpropanamide
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/C22H21FN4O3S/c1-15(2)21(28)25-17-9-11-19(12-10-17)31(29,30)27-22-24-14-13-18(26-22)8-7-16-5-3-4-6-20(16)23/h3-15H,1-2H3,(H,25,28)(H,24,26,27)/b8-7+
InChIKey SNJONJXOELWAGR-BQYQJAHWSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18067
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: D31677; Labnumber: VGU-0022118; SBI_ID: SBI-018070
Synonyms N-{4-[({4-[2-(2-fluorophenyl)ethenyl]-2-pyrimidinyl}amino)sulfonyl]phenyl}-2-methylpropanamide
Temperature 318 °C