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

*Links on SpectraBase are not permalinks.

2-[3-[1-[4-(2-PYRIDYL)-PIPERAZINYL]]-PROPYL]-2H-THIENO-[2,3-E]-[1,2,4]-THIADIAZIN-3(4H)-ONE-1,1-DIOXIDE-MONO-HYDROBROMIDE

View entire compound with spectra: 1 NMR

2-[3-[1-[4-(2-PYRIDYL)-PIPERAZINYL]]-PROPYL]-2H-THIENO-[2,3-E]-[1,2,4]-THIADIAZIN-3(4H)-ONE-1,1-DIOXIDE-MONO-HYDROBROMIDE
SpectraBase Compound ID 42ST2WR7BOO
InChI InChI=1S/C17H21N5O3S2.BrH/c23-17-19-16-14(5-13-26-16)27(24,25)22(17)8-3-7-20-9-11-21(12-10-20)15-4-1-2-6-18-15;/h1-2,4-6,13H,3,7-12H2,(H,19,23);1H
InChIKey FSGOXCJZKSUFRO-UHFFFAOYSA-N
Mol Weight 488.42 g/mol
Molecular Formula C17H22BrN5O3S2
Exact Mass 487.034745 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID Fl8v7IKSPuj
Name 2-[3-[1-[4-(2-PYRIDYL)-PIPERAZINYL]]-PROPYL]-2H-THIENO-[2,3-E]-[1,2,4]-THIADIAZIN-3(4H)-ONE-1,1-DIOXIDE-MONO-HYDROBROMIDE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22BrN5O3S2
InChI InChI=1S/C17H21N5O3S2.BrH/c23-17-19-16-14(5-13-26-16)27(24,25)22(17)8-3-7-20-9-11-21(12-10-20)15-4-1-2-6-18-15;/h1-2,4-6,13H,3,7-12H2,(H,19,23);1H
InChIKey FSGOXCJZKSUFRO-UHFFFAOYSA-N
Literature Reference Author S.VEGA,M.E.ARRANZ,V.J.ARAN
Literature Reference Citation J.HETCYCL.CHEM.,42,763(2005)
Literature Reference DOI 10.1002/jhet.5570420504
Molecular Weight 488.417 g/mol
Sample ID 61100
Solvent DMSO-D6