3-Ethyl-4-(4-Methyl-1,2-Oxazol-5-Yl)-5-(Methylsulfanyl)-2-Thiophenecarboxamide

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Properties Simple | Detailed

Formula C12H14N2O2S2
IUPAC Name 3-ethyl-4-(4-methylisoxazol-5-yl)-5-methylsulfanyl-thiophene-2-carboxamide
Molecular Mass 282.382 g·mol−1
Heat of Formation -88.2 ± 16.7 kJ·mol−1
Dipole Moment 1.71 ± 1.08 D
Volume 326.82 Å 3
Surface Area 277.04 Å 2
HOMO Energy -8.55 ± 0.55 eV
LUMO Energy -1.07 ± eV
Point Group Symmetry C1
Synonyms
  • 3-ethyl-4-(4-methyl-1,2-oxazol-5-yl)-5-methylsulfanyl-thiophene-2-carboxamide
  • 3-ethyl-4-(4-methyl-1,2-oxazol-5-yl)-5-methylsulfanylthiophene-2-carboxamide
  • 3-ethyl-4-(4-methyl-5-isoxazolyl)-5-(methylthio)-2-thiophenecarboxamide
  • 3-ethyl-4-(4-methylisoxazol-5-yl)-5-(methylthio)thiophene-2-carboxamide
InChIKey QTRKIPYBGJHAMU-UHFFFAOYSA-N
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