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2-{[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-isopropylphenyl)acetamide
SpectraBase Compound ID CCRueurzUXk
InChI InChI=1S/C23H20ClN3OS2/c1-14(2)17-5-3-4-6-19(17)27-20(28)12-30-23-21-18(11-29-22(21)25-13-26-23)15-7-9-16(24)10-8-15/h3-11,13-14H,12H2,1-2H3,(H,27,28)
InChIKey NBZWHUOCCKKSHE-UHFFFAOYSA-N
Mol Weight 454.01 g/mol
Molecular Formula C23H20ClN3OS2
Exact Mass 453.073632 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fnmm23VGc4h
Name 2-{[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-isopropylphenyl)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/C23H20ClN3OS2/c1-14(2)17-5-3-4-6-19(17)27-20(28)12-30-23-21-18(11-29-22(21)25-13-26-23)15-7-9-16(24)10-8-15/h3-11,13-14H,12H2,1-2H3,(H,27,28)
InChIKey NBZWHUOCCKKSHE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12425
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: D74528; Labnumber: GRESKO-2048; SBI_ID: SBI-012428
Temperature 318 °C