(3S)-4-({4-[(4-Amino-2-Butyn-1-Yl)Oxy]Phenyl}Sulfonyl)-N-Hydroxy-2,2-Dimethyl-3-Thiomorpholinecarboxamide

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Formula C17H23N3O5S2
IUPAC Name (3s,4r)-4-[4-(4-aminobut-2-ynoxy)phenyl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carbohydroxamic acid
Molecular Mass 413.512 g·mol−1
Heat of Formation -404.0 ± 16.7 kJ·mol−1
Dipole Moment 3.68 ± 1.08 D
Volume 461.6 Å 3
Surface Area 380.01 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy -0.78 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-4-[4-(4-aminobut-2-ynoxy)phenyl]sulfonyl-2,2-dimethyl-3-thiomorpholinecarbohydroxamic acid
  • (3s)-4-[4-(4-aminobut-2-ynoxy)phenyl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carbohydroxamic acid
  • (3s)-4-[4-(4-aminobut-2-ynoxy)phenyl]sulfonyl-n-hydroxy-2,2-dimethyl-thiomorpholine-3-carboxamide
  • (3s)-4-[4-(4-aminobut-2-ynoxy)phenyl]sulfonyl-n-hydroxy-2,2-dimethylthiomorpholine-3-carboxamide
  • 4-({4-[(4-aminobut-2-ynyl)oxy]phenyl}sulfonyl)-n-hydroxy-2,2-dimethylthiomorpholine-3-carboxamide
  • 4nh
InChIKey AANXPIMDONQTQF-HNNXBMFYSA-N
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