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acetamide, 2-[[2-(4-chlorophenyl)-9-ethoxy-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]thio]-N-(3,4-dimethylphenyl)-
SpectraBase Compound ID ANV5mO6zN9n
InChI InChI=1S/C29H26ClN3O3S/c1-4-35-24-7-5-6-20-15-23-28(36-26(20)24)32-27(19-9-11-21(30)12-10-19)33-29(23)37-16-25(34)31-22-13-8-17(2)18(3)14-22/h5-14H,4,15-16H2,1-3H3,(H,31,34)
InChIKey RMQAHYJTCDGEHU-UHFFFAOYSA-N
Mol Weight 532.06 g/mol
Molecular Formula C29H26ClN3O3S
Exact Mass 531.138341 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AUK39jQoUDp
Name acetamide, 2-[[2-(4-chlorophenyl)-9-ethoxy-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]thio]-N-(3,4-dimethylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 531.138340580 u
Formula C29H26ClN3O3S
InChI InChI=1S/C29H26ClN3O3S/c1-4-35-24-7-5-6-20-15-23-28(36-26(20)24)32-27(19-9-11-21(30)12-10-19)33-29(23)37-16-25(34)31-22-13-8-17(2)18(3)14-22/h5-14H,4,15-16H2,1-3H3,(H,31,34)
InChIKey RMQAHYJTCDGEHU-UHFFFAOYSA-N
Molecular Weight 532.058 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3318
Solvent DMSO-d6
Source Vendor ID: NMR/13278921