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3-phenyl-2-[(4-pyridinylmethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 6hiF85Mv7HB
InChI InChI=1S/C22H19N3OS2/c26-21-19-17-8-4-5-9-18(17)28-20(19)24-22(25(21)16-6-2-1-3-7-16)27-14-15-10-12-23-13-11-15/h1-3,6-7,10-13H,4-5,8-9,14H2
InChIKey GXZQAURUXKDMHT-UHFFFAOYSA-N
Mol Weight 405.53 g/mol
Molecular Formula C22H19N3OS2
Exact Mass 405.096955 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LKQ8v0KdkLe
Name 3-phenyl-2-[(4-pyridinylmethyl)sulfanyl]-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/C22H19N3OS2/c26-21-19-17-8-4-5-9-18(17)28-20(19)24-22(25(21)16-6-2-1-3-7-16)27-14-15-10-12-23-13-11-15/h1-3,6-7,10-13H,4-5,8-9,14H2
InChIKey GXZQAURUXKDMHT-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3197
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/10211326; Labnumber: LP-2100063