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(2Z)-2-(1,3-benzodioxol-5-ylmethylene)-5-(4-fluorophenyl)-7-methyl-3-oxo-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SpectraBase Compound ID 5DxC4vJgfGB
InChI InChI=1S/C28H20FN3O4S/c1-16-24(26(33)31-20-5-3-2-4-6-20)25(18-8-10-19(29)11-9-18)32-27(34)23(37-28(32)30-16)14-17-7-12-21-22(13-17)36-15-35-21/h2-14,25H,15H2,1H3,(H,31,33)/b23-14-
InChIKey WFFRYVYJLVFLHK-UCQKPKSFSA-N
Mol Weight 513.54 g/mol
Molecular Formula C28H20FN3O4S
Exact Mass 513.115855 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3QmZ8fg2ZUU
Name (2Z)-2-(1,3-benzodioxol-5-ylmethylene)-5-(4-fluorophenyl)-7-methyl-3-oxo-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
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/C28H20FN3O4S/c1-16-24(26(33)31-20-5-3-2-4-6-20)25(18-8-10-19(29)11-9-18)32-27(34)23(37-28(32)30-16)14-17-7-12-21-22(13-17)36-15-35-21/h2-14,25H,15H2,1H3,(H,31,33)/b23-14-
InChIKey WFFRYVYJLVFLHK-UCQKPKSFSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_4358
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: 120138; Labnumber: PAVL-06017; VK_ID: VK-004359
Synonyms 2-(1,3-benzodioxol-5-ylmethylene)-5-(4-fluorophenyl)-7-methyl-3-oxo-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Temperature 308 °C