For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

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

View entire compound with spectra: 2 NMR

2-{[3-(4-bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide
SpectraBase Compound ID TAVo7p6cfC
InChI InChI=1S/C24H18BrCl2N3O2S2/c25-13-5-7-17(8-6-13)30-23(32)21-18-3-1-2-4-19(18)34-22(21)29-24(30)33-12-20(31)28-16-10-14(26)9-15(27)11-16/h5-11H,1-4,12H2,(H,28,31)
InChIKey NLNRQFLKULAMRK-UHFFFAOYSA-N
Mol Weight 595.36 g/mol
Molecular Formula C24H18BrCl2N3O2S2
Exact Mass 592.940088 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3ltotQwVlEU
Name 2-{[3-(4-Bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-D]pyrimidin-2-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 592.940087578 u
Formula C24H18BrCl2N3O2S2
InChI InChI=1S/C24H18BrCl2N3O2S2/c25-13-5-7-17(8-6-13)30-23(32)21-18-3-1-2-4-19(18)34-22(21)29-24(30)33-12-20(31)28-16-10-14(26)9-15(27)11-16/h5-11H,1-4,12H2,(H,28,31)
InChIKey NLNRQFLKULAMRK-UHFFFAOYSA-N
Molecular Weight 595.357 g/mol
SMILES N(C1=CC(Cl)=CC(=C1)Cl)C(CSC=1N(C(C2=C(N1)SC1=C2CCCC1)=O)C1=CC=C(C=C1)Br)=O