Epelsiban besylate

Catalog No. :
ACHGBY554
CAS No. :
1159097-48-9
Molecular Formula :
C36H44N4O7S
Molecular Weight :
676.84

IUPAC Name:(3R,6R)-6-((S)-sec-butyl)-3-(2,3-dihydro-1H-inden-2-yl)-1-((R)-1-(2,6-dimethylpyridin-3-yl)-2-morpholino-2-oxoethyl)piperazine-2,5-dione benzenesulfonate

Epelsiban besylate structure diagram
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Product Information

Product NameEpelsiban besylate
IUPAC Name(3R,6R)-6-((S)-sec-butyl)-3-(2,3-dihydro-1H-inden-2-yl)-1-((R)-1-(2,6-dimethylpyridin-3-yl)-2-morpholino-2-oxoethyl)piperazine-2,5-dione benzenesulfonate
Molecular FormulaC36H44N4O7S
Molecular Weight676.84
SMILESO=C([C@@H](C1CC2=C(C=CC=C2)C1)N3)N([C@H](C4=CC=C(C)N=C4C)C(N5CCOCC5)=O)[C@H]([C@@H](C)CC)C3=O.O=S(C6=CC=CC=C6)(O)=O
InChI KeyBEWUOCYETMDWGE-FKDQZALLSA-N
Synonym(3R,6R)-3-(2,3-dihydro-1H-inden-2-yl)-1-[(1R)-1-(2,6-dimethyl-3-pyridinyl)-2-(4-morpholinyl)-2-oxoethyl]-6-[(1S)-1-methylpropyl]-2,5-piperazinedione benzenesulfonic acid;Epelsiban besylate;GSK557296B;GSK-557296B
CAS No.1159097-48-9

Synthetic Route by SureRoute

1. ACHGBY554 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACHGBY554 route product structure diagram
    ACHGBY5541159097-48-9
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2. ACHGBY554 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACHGBY554 route product structure diagram
    ACHGBY5541159097-48-9
Inquiry

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