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

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N-(2-chlorobenzyl)-6-(1-(2-fluorobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide
SpectraBase Compound ID 7xm1mjEuRRd
InChI InChI=1S/C26H25ClFN3O3S/c27-20-10-5-3-8-18(20)16-29-23(32)12-2-1-7-14-30-25(33)24-22(13-15-35-24)31(26(30)34)17-19-9-4-6-11-21(19)28/h3-6,8-11,13,15H,1-2,7,12,14,16-17H2,(H,29,32)
InChIKey QZXCMNLWYQMSOB-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 B7aIxJZjCOg
Name N-(2-chlorobenzyl)-6-(1-(2-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/c27-20-10-5-3-8-18(20)16-29-23(32)12-2-1-7-14-30-25(33)24-22(13-15-35-24)31(26(30)34)17-19-9-4-6-11-21(19)28/h3-6,8-11,13,15H,1-2,7,12,14,16-17H2,(H,29,32)
InChIKey QZXCMNLWYQMSOB-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_6770
Solvent DMSO-d6
Source Vendor ID: NMR/12329117