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acetamide, N-(3-cyano-4,5,6,7-tetrahydro-6-methylbenzo[b]thien-2-yl)-2-[(5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio]-
SpectraBase Compound ID CLCSFRLMbmq
InChI InChI=1S/C22H22N4OS3/c1-12-6-7-13-15(9-23)20(30-17(13)8-12)26-18(27)10-28-21-19-14-4-2-3-5-16(14)29-22(19)25-11-24-21/h11-12H,2-8,10H2,1H3,(H,26,27)
InChIKey PVORGNOTXOSQBY-UHFFFAOYSA-N
Mol Weight 454.63 g/mol
Molecular Formula C22H22N4OS3
Exact Mass 454.095575 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JKMZzMhWAbR
Name acetamide, N-(3-cyano-4,5,6,7-tetrahydro-6-methylbenzo[b]thien-2-yl)-2-[(5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-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/C22H22N4OS3/c1-12-6-7-13-15(9-23)20(30-17(13)8-12)26-18(27)10-28-21-19-14-4-2-3-5-16(14)29-22(19)25-11-24-21/h11-12H,2-8,10H2,1H3,(H,26,27)
InChIKey PVORGNOTXOSQBY-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_273
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/11219972