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#4B;2-[(PARA-METHYLPHENYLAMINOSULFONYL)-METHYL]-5-[(4',5'-DIHYDRO-1',3'-DIPHENYL-5'-(PARA-METHYLPHENYL)-1'H-PYRAZOL-4'-YL-SULFONYL)-METHYL]-1,3,4-OXADIAZOLE

View entire compound with spectra: 1 NMR

#4B;2-[(PARA-METHYLPHENYLAMINOSULFONYL)-METHYL]-5-[(4',5'-DIHYDRO-1',3'-DIPHENYL-5'-(PARA-METHYLPHENYL)-1'H-PYRAZOL-4'-YL-SULFONYL)-METHYL]-1,3,4-OXADIAZOLE
SpectraBase Compound ID EIbKmBKMYS5
InChI InChI=1S/C33H31N5O5S2/c1-23-13-17-26(18-14-23)32-33(31(25-9-5-3-6-10-25)36-38(32)28-11-7-4-8-12-28)44(39,40)21-29-34-35-30(43-29)22-45(41,42)37-27-19-15-24(2)16-20-27/h3-20,32-33,37H,21-22H2,1-2H3
InChIKey JOLLTMFXVGKOSH-UHFFFAOYSA-N
Mol Weight 641.8 g/mol
Molecular Formula C33H31N5O5S2
Exact Mass 641.176661 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KpyCLiOIvSY
Name #4B;2-[(PARA-METHYLPHENYLAMINOSULFONYL)-METHYL]-5-[(4',5'-DIHYDRO-1',3'-DIPHENYL-5'-(PARA-METHYLPHENYL)-1'H-PYRAZOL-4'-YL-SULFONYL)-METHYL]-1,3,4-OXADIAZOLE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H31N5O5S2
InChI InChI=1S/C33H31N5O5S2/c1-23-13-17-26(18-14-23)32-33(31(25-9-5-3-6-10-25)36-38(32)28-11-7-4-8-12-28)44(39,40)21-29-34-35-30(43-29)22-45(41,42)37-27-19-15-24(2)16-20-27/h3-20,32-33,37H,21-22H2,1-2H3
InChIKey JOLLTMFXVGKOSH-UHFFFAOYSA-N
Literature Reference Author G.M.REDDY,A.MURALIKRISHNA,V.PADMAVATHI,A.PADMAJA,T.K.TILAK,C .A.RAO
Literature Reference Citation CHEM.PHARM.BULL.,61,1291(2013)
Literature Reference DOI 10.1248/cpb.c13-00652
Molecular Weight 641.760 g/mol
Source File Reference UWIR4208