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N-(3,5-dichlorophenyl)-2-{[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide

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N-(3,5-dichlorophenyl)-2-{[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
SpectraBase Compound ID CwYp0FZWZmP
InChI InChI=1S/C26H23Cl2N3O3S2/c1-2-34-19-9-7-18(8-10-19)31-25(33)23-20-5-3-4-6-21(20)36-24(23)30-26(31)35-14-22(32)29-17-12-15(27)11-16(28)13-17/h7-13H,2-6,14H2,1H3,(H,29,32)
InChIKey BKOGDMORDDHORM-UHFFFAOYSA-N
Mol Weight 560.51 g/mol
Molecular Formula C26H23Cl2N3O3S2
Exact Mass 559.055789 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BxP4MPOAIi3
Name N-(3,5-dichlorophenyl)-2-{[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
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/C26H23Cl2N3O3S2/c1-2-34-19-9-7-18(8-10-19)31-25(33)23-20-5-3-4-6-21(20)36-24(23)30-26(31)35-14-22(32)29-17-12-15(27)11-16(28)13-17/h7-13H,2-6,14H2,1H3,(H,29,32)
InChIKey BKOGDMORDDHORM-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17353
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: D25623; Labnumber: GRES-04715; SBI_ID: SBI-017356
Temperature 306 °C