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2-{[4-oxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
SpectraBase Compound ID DXpGjBsWlaE
InChI InChI=1S/C20H21N3O2S2/c21-16(24)12-26-20-22-18-17(14-8-4-5-9-15(14)27-18)19(25)23(20)11-10-13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-12H2,(H2,21,24)
InChIKey PMGKWTBMMPLSGG-UHFFFAOYSA-N
Mol Weight 399.53 g/mol
Molecular Formula C20H21N3O2S2
Exact Mass 399.107519 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DT7EO3Cf09I
Name 2-{[4-oxo-3-(2-phenylethyl)-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/C20H21N3O2S2/c21-16(24)12-26-20-22-18-17(14-8-4-5-9-15(14)27-18)19(25)23(20)11-10-13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-12H2,(H2,21,24)
InChIKey PMGKWTBMMPLSGG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7921
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/1268147; Labnumber: COL6435; UZI_ID: UZI-007923
Temperature 306 °C