5,5'-[(1E)-1-Propen-1-Yl-3-Ylidene]Bis(1,3-Diethyl-2-Thioxodihydro-4,6(1H,5H)-Pyrimidinedione)

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Properties Simple | Detailed

Formula C19H24N4O4S2
IUPAC Name 5-[(e)-3-(1,3-diethyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl)prop-2-enylidene]-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-dione
Molecular Mass 436.548 g·mol−1
Heat of Formation -481.7 ± 16.7 kJ·mol−1
Dipole Moment 1.84 ± 1.08 D
Volume 507.3 Å 3
Surface Area 424.2 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -1.82 ± eV
Point Group Symmetry C1
Synonyms
  • 4,6(1h,5h)-pyrimidinedione, 5-(3-(1,3-diethylhexahydro-4,6-dioxo-2-thioxo-5-pyrimidinyl)-2-propenylidene)-1,3-diethyldihydro-2-thioxo-
  • 5-(2-allylidene-3-(1,3-diethylhexahydro-4,6-dioxo-2-thioxopyrimidin-5-yl))-1,3-diethyldihydro-2-thioxo-1h,5h-pyrimidine-4,6-dione
  • 5-[(e)-3-(1,3-diethyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-yl)prop-2-enylidene]-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-quinone
  • 5-[(e)-3-(1,3-diethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl)prop-2-enylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
  • 5-[(e)-3-(1,3-diethyl-4,6-dioxo-2-thioxo-5-hexahydropyrimidinyl)prop-2-enylidene]-1,3-diethyl-2-thioxohexahydropyrimidine-4,6-dione
  • 5-[(e)-3-(1,3-diethyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl)prop-2-enylidene]-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-dione
  • 5-[3-(1,3-diethyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-yl)prop-2-enylidene]-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-quinone
  • 5-[3-(1,3-diethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl)prop-2-enylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
  • 5-[3-(1,3-diethyl-4,6-dioxo-2-thioxo-5-hexahydropyrimidinyl)prop-2-enylidene]-1,3-diethyl-2-thioxohexahydropyrimidine-4,6-dione
  • 5-[3-(1,3-diethyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl)prop-2-enylidene]-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-dione
  • bis(1,3-diethylthiobarbiturate)trimethineoxonol
CAS Number(s)
  • 47623-98-3
InChIKey VJYNRXFXHKIGLT-MDZDMXLPSA-N
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