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2-{4-[(2,4-dichlorobenzyl)oxy]-3-ethoxyphenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID HEOPqRDYvSK
InChI InChI=1S/C25H22Cl2N2O3S/c1-2-31-20-11-14(8-10-19(20)32-13-15-7-9-16(26)12-18(15)27)23-28-24(30)22-17-5-3-4-6-21(17)33-25(22)29-23/h7-12H,2-6,13H2,1H3,(H,28,29,30)
InChIKey ZHLFNHAFJOIHAF-UHFFFAOYSA-N
Mol Weight 501.43 g/mol
Molecular Formula C25H22Cl2N2O3S
Exact Mass 500.072819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 72r4Ou7jb3S
Name 2-{4-[(2,4-dichlorobenzyl)oxy]-3-ethoxyphenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H22Cl2N2O3S/c1-2-31-20-11-14(8-10-19(20)32-13-15-7-9-16(26)12-18(15)27)23-28-24(30)22-17-5-3-4-6-21(17)33-25(22)29-23/h7-12H,2-6,13H2,1H3,(H,28,29,30)
InChIKey ZHLFNHAFJOIHAF-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7147
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 127214; Labnumber: CEP-23237; VK_ID: VK-007151
Temperature 308 °C