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acetamide, N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-2-[[3,4-dihydro-4-oxo-5-phenyl-3-(2-propenyl)thieno[2,3-d]pyrimidin-2-yl]thio]-
SpectraBase Compound ID LgkSOilzjAT
InChI InChI=1S/C27H24N4O2S3/c1-2-13-31-26(33)23-20(17-9-5-3-6-10-17)15-34-25(23)30-27(31)35-16-22(32)29-24-19(14-28)18-11-7-4-8-12-21(18)36-24/h2-3,5-6,9-10,15H,1,4,7-8,11-13,16H2,(H,29,32)
InChIKey PSPCRHICWWGFHW-UHFFFAOYSA-N
Mol Weight 532.7 g/mol
Molecular Formula C27H24N4O2S3
Exact Mass 532.10614 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID oAsX5SHZkQ
Name acetamide, N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-2-[[3,4-dihydro-4-oxo-5-phenyl-3-(2-propenyl)thieno[2,3-d]pyrimidin-2-yl]thio]-
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/C27H24N4O2S3/c1-2-13-31-26(33)23-20(17-9-5-3-6-10-17)15-34-25(23)30-27(31)35-16-22(32)29-24-19(14-28)18-11-7-4-8-12-21(18)36-24/h2-3,5-6,9-10,15H,1,4,7-8,11-13,16H2,(H,29,32)
InChIKey PSPCRHICWWGFHW-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_916
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: NMR/11228621