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[4-(1-BENZYL-2-ETHYL-4-NITRO-1H-IMIDAZOL-5-YL)-PIPERAZIN-1-YL]-(THIOPHEN-2-YL)-KETONE
SpectraBase Compound ID Ek5XrqIyUt8
InChI InChI=1S/C21H23N5O3S/c1-2-18-22-19(26(28)29)20(25(18)15-16-7-4-3-5-8-16)23-10-12-24(13-11-23)21(27)17-9-6-14-30-17/h3-9,14H,2,10-13,15H2,1H3
InChIKey JECWJHNXFXMEFX-UHFFFAOYSA-N
Mol Weight 425.51 g/mol
Molecular Formula C21H23N5O3S
Exact Mass 425.152161 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dtn2Mi9UiS0
Name [4-(1-BENZYL-2-ETHYL-4-NITRO-1H-IMIDAZOL-5-YL)-PIPERAZIN-1-YL]-(THIOPHEN-2-YL)-KETONE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23N5O3S
InChI InChI=1S/C21H23N5O3S/c1-2-18-22-19(26(28)29)20(25(18)15-16-7-4-3-5-8-16)23-10-12-24(13-11-23)21(27)17-9-6-14-30-17/h3-9,14H,2,10-13,15H2,1H3
InChIKey JECWJHNXFXMEFX-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 425.505 g/mol
Solvent Unknown
Source File Reference UWLU79042