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1-[4-(1-BENZYL-2-ETHYL-4-NITRO-1H-IMIDAZOL-5-YL)-PIPERAZIN-1-YL]-2-(BENZYLTHIO)-ETHANONE
SpectraBase Compound ID BIcDTZe9HoS
InChI InChI=1S/C25H29N5O3S/c1-2-22-26-24(30(32)33)25(29(22)17-20-9-5-3-6-10-20)28-15-13-27(14-16-28)23(31)19-34-18-21-11-7-4-8-12-21/h3-12H,2,13-19H2,1H3
InChIKey AMJBYJHPQJPUIO-UHFFFAOYSA-N
Mol Weight 479.6 g/mol
Molecular Formula C25H29N5O3S
Exact Mass 479.199111 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7FlEUvcRRS
Name 1-[4-(1-BENZYL-2-ETHYL-4-NITRO-1H-IMIDAZOL-5-YL)-PIPERAZIN-1-YL]-2-(BENZYLTHIO)-ETHANONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H29N5O3S
InChI InChI=1S/C25H29N5O3S/c1-2-22-26-24(30(32)33)25(29(22)17-20-9-5-3-6-10-20)28-15-13-27(14-16-28)23(31)19-34-18-21-11-7-4-8-12-21/h3-12H,2,13-19H2,1H3
InChIKey AMJBYJHPQJPUIO-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 479.597 g/mol
Solvent Unknown
Source File Reference UWLU79031