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BIS-[3-(4'-BIPHENYL)-4-[[4-ACETOXY-2-(N-PHENYL-ACETAMIDO)-4,5-DIHYDRO-1,3,4-THIADIAZOL-5-YL]-1H-PYRAZOL-1-YL]-PHOSPHINE-OXIDE

View entire compound with spectra: 1 NMR

BIS-[3-(4'-BIPHENYL)-4-[[4-ACETOXY-2-(N-PHENYL-ACETAMIDO)-4,5-DIHYDRO-1,3,4-THIADIAZOL-5-YL]-1H-PYRAZOL-1-YL]-PHOSPHINE-OXIDE
SpectraBase Compound ID 62oTAvTCAbU
InChI InChI=1S/C54H45N10O5PS2/c1-35(65)61(45-21-13-7-14-22-45)53-57-63(37(3)67)51(71-53)47-33-59(55-49(47)43-29-25-41(26-30-43)39-17-9-5-10-18-39)70(69)60-34-48(50(56-60)44-31-27-42(28-32-44)40-19-11-6-12-20-40)52-64(38(4)68)58-54(72-52)62(36(2)66)46-23-15-8-16-24-46/h5-34,51-52,70H,1-4H3
InChIKey YDRSHGXYNOZZKU-UHFFFAOYSA-N
Mol Weight 1009.1 g/mol
Molecular Formula C54H45N10O5PS2
Exact Mass 1008.275344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4lisXQxRzes
Name BIS-[3-(4'-BIPHENYL)-4-[[4-ACETOXY-2-(N-PHENYL-ACETAMIDO)-4,5-DIHYDRO-1,3,4-THIADIAZOL-5-YL]-1H-PYRAZOL-1-YL]-PHOSPHINE-OXIDE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H44N10O5PS2
InChI InChI=1S/C54H45N10O5PS2/c1-35(65)61(45-21-13-7-14-22-45)53-57-63(37(3)67)51(71-53)47-33-59(55-49(47)43-29-25-41(26-30-43)39-17-9-5-10-18-39)70(69)60-34-48(50(56-60)44-31-27-42(28-32-44)40-19-11-6-12-20-40)52-64(38(4)68)58-54(72-52)62(36(2)66)46-23-15-8-16-24-46/h5-34,51-52,70H,1-4H3
InChIKey YDRSHGXYNOZZKU-UHFFFAOYSA-N
Literature Reference Author S.A.G.ABDEL-AZIZ,T.E.S.ALI,K.M.EL-MAHDY,S.M.ABDEL-KARIM
Literature Reference Citation EUR.J.CHEM.,2,25(2011)
Literature Reference DOI 10.5155/eurjchem.2.1.25-35.208
Molecular Weight 1008.101 g/mol
Solvent DMSO-D6
Source File Reference UWLU83216