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

View entire compound with spectra: 1 NMR

2-{[3-(4-bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
SpectraBase Compound ID 5rJ1aXTAw5q
InChI InChI=1S/C26H22BrN3O4S2/c27-15-5-8-17(9-6-15)30-25(32)23-18-3-1-2-4-21(18)36-24(23)29-26(30)35-14-22(31)28-16-7-10-19-20(13-16)34-12-11-33-19/h5-10,13H,1-4,11-12,14H2,(H,28,31)
InChIKey GLCNIQPIGWSXSE-UHFFFAOYSA-N
Mol Weight 584.5 g/mol
Molecular Formula C26H22BrN3O4S2
Exact Mass 583.023512 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FxbB7b5C3Lz
Name 2-{[3-(4-bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)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/C26H22BrN3O4S2/c27-15-5-8-17(9-6-15)30-25(32)23-18-3-1-2-4-21(18)36-24(23)29-26(30)35-14-22(31)28-16-7-10-19-20(13-16)34-12-11-33-19/h5-10,13H,1-4,11-12,14H2,(H,28,31)
InChIKey GLCNIQPIGWSXSE-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17067
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: D25474; Labnumber: GRES-04548; SBI_ID: SBI-017070
Temperature 308 °C