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3-thiophenecarboxamide, 2-[[[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-5-phenyl-
SpectraBase Compound ID 8MwgBU2LRiH
InChI InChI=1S/C21H18N4O2S3/c1-11-12(2)29-21-17(11)20(23-10-24-21)28-9-16(26)25-19-14(18(22)27)8-15(30-19)13-6-4-3-5-7-13/h3-8,10H,9H2,1-2H3,(H2,22,27)(H,25,26)
InChIKey XFVCDQYDBGVIEW-UHFFFAOYSA-N
Mol Weight 454.58 g/mol
Molecular Formula C21H18N4O2S3
Exact Mass 454.059189 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6JJfm1tZ923
Name 3-thiophenecarboxamide, 2-[[[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-5-phenyl-
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/C21H18N4O2S3/c1-11-12(2)29-21-17(11)20(23-10-24-21)28-9-16(26)25-19-14(18(22)27)8-15(30-19)13-6-4-3-5-7-13/h3-8,10H,9H2,1-2H3,(H2,22,27)(H,25,26)
InChIKey XFVCDQYDBGVIEW-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_912
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/11228616