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2-(heptylsulfanyl)-3-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 2EgqHhUuVK8
InChI InChI=1S/C25H32N2OS2/c1-2-3-4-5-11-18-29-25-26-23-22(20-14-9-10-15-21(20)30-23)24(28)27(25)17-16-19-12-7-6-8-13-19/h6-8,12-13H,2-5,9-11,14-18H2,1H3
InChIKey LQXLJAFNAHATON-UHFFFAOYSA-N
Mol Weight 440.7 g/mol
Molecular Formula C25H32N2OS2
Exact Mass 440.195606 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2RzqNlwfF5l
Name 2-(heptylsulfanyl)-3-(2-phenylethyl)-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/C25H32N2OS2/c1-2-3-4-5-11-18-29-25-26-23-22(20-14-9-10-15-21(20)30-23)24(28)27(25)17-16-19-12-7-6-8-13-19/h6-8,12-13H,2-5,9-11,14-18H2,1H3
InChIKey LQXLJAFNAHATON-UHFFFAOYSA-N
NMR Offset 15.3548
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12109
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: 801137; Labnumber: AE95-669; VK_ID: VK-012114
Temperature 318 °C