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N-(3-chloro-2-methylphenyl)-2-{[4-oxo-3-(4-pyridinylmethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide

View entire compound with spectra: 1 NMR

N-(3-chloro-2-methylphenyl)-2-{[4-oxo-3-(4-pyridinylmethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
SpectraBase Compound ID IE9YlCbD9kz
InChI InChI=1S/C25H23ClN4O2S2/c1-15-18(26)6-4-7-19(15)28-21(31)14-33-25-29-23-22(17-5-2-3-8-20(17)34-23)24(32)30(25)13-16-9-11-27-12-10-16/h4,6-7,9-12H,2-3,5,8,13-14H2,1H3,(H,28,31)
InChIKey HEILJZIAEOYBGW-UHFFFAOYSA-N
Mol Weight 511.06 g/mol
Molecular Formula C25H23ClN4O2S2
Exact Mass 510.095096 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Y3NqYNY997
Name N-(3-chloro-2-methylphenyl)-2-{[4-oxo-3-(4-pyridinylmethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
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/C25H23ClN4O2S2/c1-15-18(26)6-4-7-19(15)28-21(31)14-33-25-29-23-22(17-5-2-3-8-20(17)34-23)24(32)30(25)13-16-9-11-27-12-10-16/h4,6-7,9-12H,2-3,5,8,13-14H2,1H3,(H,28,31)
InChIKey HEILJZIAEOYBGW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8064
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/1269667; Labnumber: COL6706; UZI_ID: UZI-008066
Temperature 306 °C