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N-(5,6-dimethyl-4-oxo-2-sulfanylthieno[2,3-d]pyrimidin-3(4H)-yl)-1,3-benzodioxole-5-carboxamide
SpectraBase Compound ID EDEo954lbxd
InChI InChI=1S/C16H13N3O4S2/c1-7-8(2)25-14-12(7)15(21)19(16(24)17-14)18-13(20)9-3-4-10-11(5-9)23-6-22-10/h3-5H,6H2,1-2H3,(H,17,24)(H,18,20)
InChIKey QSKGNVYVWVBSMK-UHFFFAOYSA-N
Mol Weight 375.42 g/mol
Molecular Formula C16H13N3O4S2
Exact Mass 375.034748 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3rlShhfq6Ix
Name N-(5,6-dimethyl-4-oxo-2-sulfanylthieno[2,3-d]pyrimidin-3(4H)-yl)-1,3-benzodioxole-5-carboxamide
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/C16H13N3O4S2/c1-7-8(2)25-14-12(7)15(21)19(16(24)17-14)18-13(20)9-3-4-10-11(5-9)23-6-22-10/h3-5H,6H2,1-2H3,(H,17,24)(H,18,20)
InChIKey QSKGNVYVWVBSMK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8016
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: UZI/1268986; Labnumber: COL6606; UZI_ID: UZI-008018
Temperature 306 °C