2-Ethoxyethyl {[4-(3-Methyl-1,2-Oxazol-5-Yl)-1,3-Thiazol-2-Yl]Amino}(Oxo)Acetate

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Properties Simple | Detailed

Formula C13H15N3O5S
IUPAC Name 2-ethoxyethyl 2-[[4-(3-methylisoxazol-5-yl)thiazol-2-yl]amino]-2-oxo-acetate
Molecular Mass 325.340 g·mol−1
Heat of Formation -453.1 ± 16.7 kJ·mol−1
Dipole Moment 2.95 ± 1.08 D
Volume 356.85 Å 3
Surface Area 340.68 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy 1.63 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[[4-(3-methyl-5-isoxazolyl)-2-thiazolyl]amino]-2-oxoacetic acid 2-ethoxyethyl ester
  • 2-ethoxyethyl (4-(3-methyl-5-isoxazolyl)-2-thiazolyl)oxamate
  • 2-ethoxyethyl 2-[[4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-yl]amino]-2-oxo-ethanoate
  • 2-ethoxyethyl 2-[[4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-yl]amino]-2-oxoacetate
  • 2-ethoxyethyl n-(4-(3-methyl-5-isoxazolyl)-2-thiazolyl)oxamate
  • 2-keto-2-[[4-(3-methylisoxazol-5-yl)thiazol-2-yl]amino]acetic acid 2-ethoxyethyl ester
  • asobamast
  • asobamast [ban:inn]
CAS Number(s)
  • 104777-03-9
InChIKey IKYTUOHXXXPNOG-UHFFFAOYSA-N
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