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1-[4-(1-BENZYL-2-ETHYL-4-NITRO-1H-IMIDAZOL-5-YL)-PIPERAZIN-1-YL]-2-(PHENYLTHIO)-ETHANONE
SpectraBase Compound ID 9FliU82dynu
InChI InChI=1S/C24H27N5O3S/c1-2-21-25-23(29(31)32)24(28(21)17-19-9-5-3-6-10-19)27-15-13-26(14-16-27)22(30)18-33-20-11-7-4-8-12-20/h3-12H,2,13-18H2,1H3
InChIKey NXMVAQJDOZASQU-UHFFFAOYSA-N
Mol Weight 465.57 g/mol
Molecular Formula C24H27N5O3S
Exact Mass 465.183461 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8IXvAECpvQy
Name 1-[4-(1-BENZYL-2-ETHYL-4-NITRO-1H-IMIDAZOL-5-YL)-PIPERAZIN-1-YL]-2-(PHENYLTHIO)-ETHANONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H27N5O3S
InChI InChI=1S/C24H27N5O3S/c1-2-21-25-23(29(31)32)24(28(21)17-19-9-5-3-6-10-19)27-15-13-26(14-16-27)22(30)18-33-20-11-7-4-8-12-20/h3-12H,2,13-18H2,1H3
InChIKey NXMVAQJDOZASQU-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 465.570 g/mol
Solvent Unknown
Source File Reference UWLU79028