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

*Links on SpectraBase are not permalinks.
1-[4-(1-BENZYL-2-ETHYL-4-NITRO-1H-IMIDAZOL-5-YL)-PIPERAZIN-1-YL]-2-(4-CHLOROBENZYLTHIO)-ETHANONE
SpectraBase Compound ID GnJEGnlC2Ln
InChI InChI=1S/C25H28ClN5O3S/c1-2-22-27-24(31(33)34)25(30(22)16-19-6-4-3-5-7-19)29-14-12-28(13-15-29)23(32)18-35-17-20-8-10-21(26)11-9-20/h3-11H,2,12-18H2,1H3
InChIKey AACMDMLWPMAPBV-UHFFFAOYSA-N
Mol Weight 514.04 g/mol
Molecular Formula C25H28ClN5O3S
Exact Mass 513.160139 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 DuGt0W06eg
Name 1-[4-(1-BENZYL-2-ETHYL-4-NITRO-1H-IMIDAZOL-5-YL)-PIPERAZIN-1-YL]-2-(4-CHLOROBENZYLTHIO)-ETHANONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28ClN5O3S
InChI InChI=1S/C25H28ClN5O3S/c1-2-22-27-24(31(33)34)25(30(22)16-19-6-4-3-5-7-19)29-14-12-28(13-15-29)23(32)18-35-17-20-8-10-21(26)11-9-20/h3-11H,2,12-18H2,1H3
InChIKey AACMDMLWPMAPBV-UHFFFAOYSA-N
Literature Reference Author Y.A.AL-SOUD,N.A.AL-MASOUDI,H.G.HASSAN,E.DECLERCQ,C.PANNECOUQ UE
Literature Reference Citation ACTA.PHARM.,57,379(2007)
Molecular Weight 514.042 g/mol
Solvent Unknown
Source File Reference UWLU79032