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N-(sec-butyl)-2-(3-(4-chlorophenyl)-2,4-dioxo-3,4,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl)acetamide

View entire compound with spectra: 1 NMR

N-(sec-butyl)-2-(3-(4-chlorophenyl)-2,4-dioxo-3,4,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl)acetamide
SpectraBase Compound ID LhmcckLwbgT
InChI InChI=1S/C23H26ClN3O3S/c1-3-14(2)25-19(28)13-26-22-20(17-7-5-4-6-8-18(17)31-22)21(29)27(23(26)30)16-11-9-15(24)10-12-16/h9-12,14H,3-8,13H2,1-2H3,(H,25,28)
InChIKey UPQQRIHMNIUOFV-UHFFFAOYSA-N
Mol Weight 459.99 g/mol
Molecular Formula C23H26ClN3O3S
Exact Mass 459.138341 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FCVKhbRZ3GD
Name N-(sec-butyl)-2-(3-(4-chlorophenyl)-2,4-dioxo-3,4,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl)acetamide
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 459.138340580 u
Formula C23H26ClN3O3S
InChI InChI=1S/C23H26ClN3O3S/c1-3-14(2)25-19(28)13-26-22-20(17-7-5-4-6-8-18(17)31-22)21(29)27(23(26)30)16-11-9-15(24)10-12-16/h9-12,14H,3-8,13H2,1-2H3,(H,25,28)
InChIKey UPQQRIHMNIUOFV-UHFFFAOYSA-N
Molecular Weight 459.992 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6378
Solvent DMSO-d6
Source Vendor ID: NMR/12328546