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(5Z)-5-[3-bromo-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]benzylidene]-1-(p-tolyl)barbituric acid
SpectraBase Compound ID 3A535ztnsoK
InChI InChI=1S/C29H27BrN2O6/c1-4-36-25-17-20(16-23(30)26(25)38-14-13-37-24-8-6-5-7-19(24)3)15-22-27(33)31-29(35)32(28(22)34)21-11-9-18(2)10-12-21/h5-12,15-17H,4,13-14H2,1-3H3,(H,31,33,35)/b22-15-
InChIKey CWQAPFPCTMPPOS-JCMHNJIXSA-N
Mol Weight 579.45 g/mol
Molecular Formula C29H27BrN2O6
Exact Mass 578.10525 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hk3V3T7SsCt
Name (5Z)-5-[3-bromo-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]benzylidene]-1-(p-tolyl)barbituric acid
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Formula C29H27BrN2O6
InChI InChI=1S/C29H27BrN2O6/c1-4-36-25-17-20(16-23(30)26(25)38-14-13-37-24-8-6-5-7-19(24)3)15-22-27(33)31-29(35)32(28(22)34)21-11-9-18(2)10-12-21/h5-12,15-17H,4,13-14H2,1-3H3,(H,31,33,35)/b22-15-
InChIKey CWQAPFPCTMPPOS-JCMHNJIXSA-N
Molecular Weight 579.447 g/mol
SMILES N1C(\C(C(N(C1=O)c1ccc(cc1)C)=O)=C/c1cc(Br)c(c(c1)OCC)OCCOc1c(C)cccc1)=O
SPLASH splash10-0019-1900130000-2eb20e0b0bb23bc7423d
Synonyms (5Z)-5-[[3-bromanyl-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione (5Z)-5-[[3-bromo-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]methylene]-1-(p-tolyl)hexahydropyrimidine-2,4,6-trione (5Z)-5-[[3-bromo-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione
Wiley ID 1436539