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(5Z)-1-(3-fluorophenyl)-5-[[2-(1H-indol-3-yl)ethylamino]methylene]barbituric acid
SpectraBase Compound ID BtS7vLfGY6l
InChI InChI=1S/C21H17FN4O3/c22-14-4-3-5-15(10-14)26-20(28)17(19(27)25-21(26)29)12-23-9-8-13-11-24-18-7-2-1-6-16(13)18/h1-7,10-12,23-24H,8-9H2,(H,25,27,29)/b17-12-
InChIKey QUMSDLURUWXZQT-ATVHPVEESA-N
Mol Weight 392.39 g/mol
Molecular Formula C21H17FN4O3
Exact Mass 392.128469 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 46V5nAxTfm6
Name (5Z)-1-(3-fluorophenyl)-5-[[2-(1H-indol-3-yl)ethylamino]methylene]barbituric acid
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Formula C21H17FN4O3
InChI InChI=1S/C21H17FN4O3/c22-14-4-3-5-15(10-14)26-20(28)17(19(27)25-21(26)29)12-23-9-8-13-11-24-18-7-2-1-6-16(13)18/h1-7,10-12,23-24H,8-9H2,(H,25,27,29)/b17-12-
InChIKey QUMSDLURUWXZQT-ATVHPVEESA-N
Molecular Weight 392.390 g/mol
SMILES [nH]1c2c(c(CCN\C=C/3C(N(C(NC3=O)=O)c3cc(F)ccc3)=O)c1)cccc2
SPLASH splash10-001i-0900000000-70eed65f61d21243ab79
Synonyms (5Z)-1-(3-fluorophenyl)-5-[[2-(1H-indol-3-yl)ethylamino]methylene]hexahydropyrimidine-2,4,6-trione (5Z)-1-(3-fluorophenyl)-5-[[2-(1H-indol-3-yl)ethylamino]methylidene]-1,3-diazinane-2,4,6-trione
Wiley ID 1452940