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2-[(1H-indol-3-ylmethyl)sulfanyl]-3-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID GTs5AB6qhs5
InChI InChI=1S/C20H19N3OS2/c1-23-19(24)17-14-7-3-5-9-16(14)26-18(17)22-20(23)25-11-12-10-21-15-8-4-2-6-13(12)15/h2,4,6,8,10,21H,3,5,7,9,11H2,1H3
InChIKey HOHQZEVPPCYRPL-UHFFFAOYSA-N
Mol Weight 381.51 g/mol
Molecular Formula C20H19N3OS2
Exact Mass 381.096955 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JaZrk3CQocQ
Name 2-[(1H-indol-3-ylmethyl)sulfanyl]-3-methyl-5,6,7,8-tetrahydro[1]benzothieno[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/C20H19N3OS2/c1-23-19(24)17-14-7-3-5-9-16(14)26-18(17)22-20(23)25-11-12-10-21-15-8-4-2-6-13(12)15/h2,4,6,8,10,21H,3,5,7,9,11H2,1H3
InChIKey HOHQZEVPPCYRPL-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_69
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: ZI/8036172; Labnumber: LP-0603675
Temperature 297 °C