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#4L;(Z)-ETHYL-2-[4-[4-[4-[6-AMINO-4-BENZYL-5-CYANO-2-OXOPYRIMIDIN-1(2H)-YL]-PHENYL]-1H-1,2,3-TRIAZOL-1-YL]-BENZYLIDENE]-7-METHYL-3-OXO-5-PHENYL-3,5-DIHYDRO-2H-

View entire compound with spectra: 1 NMR

#4L;(Z)-ETHYL-2-[4-[4-[4-[6-AMINO-4-BENZYL-5-CYANO-2-OXOPYRIMIDIN-1(2H)-YL]-PHENYL]-1H-1,2,3-TRIAZOL-1-YL]-BENZYLIDENE]-7-METHYL-3-OXO-5-PHENYL-3,5-DIHYDRO-2H-
SpectraBase Compound ID FLxJsnjtK2X
InChI InChI=1S/C43H33N9O4S/c1-3-56-41(54)37-26(2)46-43-52(38(37)30-12-8-5-9-13-30)40(53)36(57-43)23-28-14-18-31(19-15-28)50-25-35(48-49-50)29-16-20-32(21-17-29)51-39(45)33(24-44)34(47-42(51)55)22-27-10-6-4-7-11-27/h4-21,23,25,38H,3,22,45H2,1-2H3/b36-23-
InChIKey HVGGTPPFYDYCQV-GMEAVFFOSA-N
Mol Weight 771.9 g/mol
Molecular Formula C43H33N9O4S
Exact Mass 771.237622 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EurXSsQekNK
Name #4L;(Z)-ETHYL-2-[4-[4-[4-[6-AMINO-4-BENZYL-5-CYANO-2-OXOPYRIMIDIN-1(2H)-YL]-PHENYL]-1H-1,2,3-TRIAZOL-1-YL]-BENZYLIDENE]-7-METHYL-3-OXO-5-PHENYL-3,5-DIHYDRO-2H-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H33N9O4S
InChI InChI=1S/C43H33N9O4S/c1-3-56-41(54)37-26(2)46-43-52(38(37)30-12-8-5-9-13-30)40(53)36(57-43)23-28-14-18-31(19-15-28)50-25-35(48-49-50)29-16-20-32(21-17-29)51-39(45)33(24-44)34(47-42(51)55)22-27-10-6-4-7-11-27/h4-21,23,25,38H,3,22,45H2,1-2H3/b36-23-
InChIKey HVGGTPPFYDYCQV-GMEAVFFOSA-N
Literature Reference Author E.NAJAHI,J.SUDOR,F.CHABCHOUB,F.NEPVEU,F.ZRIBI,R.DUVAL
Literature Reference Citation MOLECULES,15,8841(2010)
Literature Reference DOI 10.3390/molecules1512884
Molecular Weight 771.853 g/mol
Sample ID 72749
Solvent DMSO-D6