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N-(2-chlorobenzyl)-6-(1-(4-fluorobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide

View entire compound with spectra: 1 NMR

N-(2-chlorobenzyl)-6-(1-(4-fluorobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide
SpectraBase Compound ID F9g2fdkaI4L
InChI InChI=1S/C26H25ClFN3O3S/c27-21-7-4-3-6-19(21)16-29-23(32)8-2-1-5-14-30-25(33)24-22(13-15-35-24)31(26(30)34)17-18-9-11-20(28)12-10-18/h3-4,6-7,9-13,15H,1-2,5,8,14,16-17H2,(H,29,32)
InChIKey KUPWRTYDGCCVKV-UHFFFAOYSA-N
Mol Weight 514.02 g/mol
Molecular Formula C26H25ClFN3O3S
Exact Mass 513.128919 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IGGtShrkyIW
Name N-(2-chlorobenzyl)-6-(1-(4-fluorobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 513.128918711 u
Formula C26H25ClFN3O3S
InChI InChI=1S/C26H25ClFN3O3S/c27-21-7-4-3-6-19(21)16-29-23(32)8-2-1-5-14-30-25(33)24-22(13-15-35-24)31(26(30)34)17-18-9-11-20(28)12-10-18/h3-4,6-7,9-13,15H,1-2,5,8,14,16-17H2,(H,29,32)
InChIKey KUPWRTYDGCCVKV-UHFFFAOYSA-N
Molecular Weight 514.015 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5931
Solvent DMSO-d6
Source Vendor ID: NMR/12319477