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3-(1-benzyl-1H-pyrazol-3-yl)-6-methyl-2-sulfanylthieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 4Lo7ehyC9j4
InChI InChI=1S/C17H14N4OS2/c1-11-9-13-15(24-11)18-17(23)21(16(13)22)14-7-8-20(19-14)10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,23)
InChIKey KLWABAJDOUJWJE-UHFFFAOYSA-N
Mol Weight 354.45 g/mol
Molecular Formula C17H14N4OS2
Exact Mass 354.060903 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J1VYvGDk5L6
Name 3-(1-benzyl-1H-pyrazol-3-yl)-6-methyl-2-sulfanylthieno[2,3-d]pyrimidin-4(3H)-one
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/C17H14N4OS2/c1-11-9-13-15(24-11)18-17(23)21(16(13)22)14-7-8-20(19-14)10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,23)
InChIKey KLWABAJDOUJWJE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8210
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/1268179; Labnumber: COL7133; UZI_ID: UZI-008212
Temperature 318 °C