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2-(3-(4-chlorophenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl)-N-(4-methoxyphenyl)acetamide

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2-(3-(4-chlorophenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl)-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID KMTQw5QuAPY
InChI InChI=1S/C25H22ClN3O4S/c1-33-18-12-8-16(9-13-18)27-21(30)14-28-24-22(19-4-2-3-5-20(19)34-24)23(31)29(25(28)32)17-10-6-15(26)7-11-17/h6-13H,2-5,14H2,1H3,(H,27,30)
InChIKey UDHJCNUTELGLCF-UHFFFAOYSA-N
Mol Weight 495.98 g/mol
Molecular Formula C25H22ClN3O4S
Exact Mass 495.101955 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 593rcgvqDn0
Name 2-(3-(4-chlorophenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl)-N-(4-methoxyphenyl)acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 495.101955070 u
Formula C25H22ClN3O4S
InChI InChI=1S/C25H22ClN3O4S/c1-33-18-12-8-16(9-13-18)27-21(30)14-28-24-22(19-4-2-3-5-20(19)34-24)23(31)29(25(28)32)17-10-6-15(26)7-11-17/h6-13H,2-5,14H2,1H3,(H,27,30)
InChIKey UDHJCNUTELGLCF-UHFFFAOYSA-N
Molecular Weight 495.981 g/mol
NMR Offset 18.9623
NMR Spectrometer Frequency 500.137
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9339
Solvent DMSO-d6
Source Vendor ID: NMR/13229207