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2-{[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(4-ethylphenyl)acetamide
SpectraBase Compound ID AMRzHhxsHaG
InChI InChI=1S/C22H18ClN3OS2/c1-2-14-3-9-17(10-4-14)26-19(27)12-29-22-20-18(11-28-21(20)24-13-25-22)15-5-7-16(23)8-6-15/h3-11,13H,2,12H2,1H3,(H,26,27)
InChIKey KBFMWCHHJUZMMS-UHFFFAOYSA-N
Mol Weight 439.98 g/mol
Molecular Formula C22H18ClN3OS2
Exact Mass 439.057982 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KuDuqbvfTWz
Name 2-{[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(4-ethylphenyl)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/C22H18ClN3OS2/c1-2-14-3-9-17(10-4-14)26-19(27)12-29-22-20-18(11-28-21(20)24-13-25-22)15-5-7-16(23)8-6-15/h3-11,13H,2,12H2,1H3,(H,26,27)
InChIKey KBFMWCHHJUZMMS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12421
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: D74521; Labnumber: GRESKO-2040; SBI_ID: SBI-012424
Temperature 318 °C