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3-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
SpectraBase Compound ID 6xnJFULorEK
InChI InChI=1S/C23H26N2O2S2/c1-2-3-14-25-22(27)20-17-12-8-5-9-13-19(17)29-21(20)24-23(25)28-15-18(26)16-10-6-4-7-11-16/h4,6-7,10-11H,2-3,5,8-9,12-15H2,1H3
InChIKey WJSRJCTVKRJVNH-UHFFFAOYSA-N
Mol Weight 426.59 g/mol
Molecular Formula C23H26N2O2S2
Exact Mass 426.14357 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KjypzUSiGsp
Name 3-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H26N2O2S2/c1-2-3-14-25-22(27)20-17-12-8-5-9-13-19(17)29-21(20)24-23(25)28-15-18(26)16-10-6-4-7-11-16/h4,6-7,10-11H,2-3,5,8-9,12-15H2,1H3
InChIKey WJSRJCTVKRJVNH-UHFFFAOYSA-N
NMR Offset 15.3548
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12157
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: 801233; Labnumber: AE95-776; VK_ID: VK-012162
Temperature 318 °C