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3-benzyl-2-[(3,4-dichlorobenzyl)sulfanyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one

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3-benzyl-2-[(3,4-dichlorobenzyl)sulfanyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
SpectraBase Compound ID K53JYR9UgPL
InChI InChI=1S/C26H24Cl2N2O2S2/c1-3-26(2)12-18-21(14-32-26)34-23-22(18)24(31)30(13-16-7-5-4-6-8-16)25(29-23)33-15-17-9-10-19(27)20(28)11-17/h4-11H,3,12-15H2,1-2H3
InChIKey BWLSOSSTHDYSFV-UHFFFAOYSA-N
Mol Weight 531.52 g/mol
Molecular Formula C26H24Cl2N2O2S2
Exact Mass 530.065626 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7aAIj7mlcdP
Name 3-benzyl-2-[(3,4-dichlorobenzyl)sulfanyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-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/C26H24Cl2N2O2S2/c1-3-26(2)12-18-21(14-32-26)34-23-22(18)24(31)30(13-16-7-5-4-6-8-16)25(29-23)33-15-17-9-10-19(27)20(28)11-17/h4-11H,3,12-15H2,1-2H3
InChIKey BWLSOSSTHDYSFV-UHFFFAOYSA-N
NMR Offset 14.4793
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_16527
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: UZI/8131512; UBI_ID: UBI-016530
Temperature 313 °C