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1-[4-(1-BENZYL-2-ETHYL-4-NITRO-1H-IMIDAZOL-5-YL)-PIPERAZIN-1-YL]-2-(4-CHLOROPHENYLTHIO)-ETHANONE
SpectraBase Compound ID 4Hz0k6akKWn
InChI InChI=1S/C24H26ClN5O3S/c1-2-21-26-23(30(32)33)24(29(21)16-18-6-4-3-5-7-18)28-14-12-27(13-15-28)22(31)17-34-20-10-8-19(25)9-11-20/h3-11H,2,12-17H2,1H3
InChIKey IFQQMZNOBPTJSG-UHFFFAOYSA-N
Mol Weight 500.02 g/mol
Molecular Formula C24H26ClN5O3S
Exact Mass 499.144489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HRu2hZ4IUOc
Name 1-[4-(1-BENZYL-2-ETHYL-4-NITRO-1H-IMIDAZOL-5-YL)-PIPERAZIN-1-YL]-2-(4-CHLOROPHENYLTHIO)-ETHANONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H26ClN5O3S
InChI InChI=1S/C24H26ClN5O3S/c1-2-21-26-23(30(32)33)24(29(21)16-18-6-4-3-5-7-18)28-14-12-27(13-15-28)22(31)17-34-20-10-8-19(25)9-11-20/h3-11H,2,12-17H2,1H3
InChIKey IFQQMZNOBPTJSG-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 500.015 g/mol
Solvent Unknown
Source File Reference UWLU79029