Prinomastat

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Properties Simple | Detailed

Formula C18H21N3O5S2
IUPAC Name (3s,4r)-2,2-dimethyl-4-[4-(3h-pyridin-1-ium-3-id-4-yloxy)phenyl]sulfonyl-thiomorpholine-3-carbohydroxamic acid
Molecular Mass 423.506 g·mol−1
Heat of Formation -475.7 ± 16.7 kJ·mol−1
Dipole Moment 4.47 ± 1.08 D
Volume 459.21 Å 3
Surface Area 373.66 Å 2
HOMO Energy -8.62 ± 0.55 eV
LUMO Energy 2.03 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-2,2-dimethyl-4-[4-(4-pyridyloxy)phenyl]sulfonyl-3-thiomorpholinecarbohydroxamic acid
  • (3s)-2,2-dimethyl-4-[4-(4-pyridyloxy)phenyl]sulfonyl-thiomorpholine-3-carbohydroxamic acid
  • (3s)-n-hydroxy-2,2-dimethyl-4-(4-pyridin-4-yloxyphenyl)sulfonyl-thiomorpholine-3-carboxamide
  • (3s)-n-hydroxy-2,2-dimethyl-4-(4-pyridin-4-yloxyphenyl)sulfonylthiomorpholine-3-carboxamide
  • 3-thiomorpholinecarboxamide, n-hydroxy-2,2-dimethyl-4-[[4-(4-pyridinyloxy)phenyl]sulfonyl]-, (3s)-
  • ag 3340
  • ag-3354
  • ag-3362
  • ag3340
  • d03797
  • prinomastat (usan)
InChIKey YKPYIPVDTNNYCN-INIZCTEOSA-N
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