rel-BIIE-0246

Catalog No. :
ACEKCR892
CAS No. :
2512225-05-5
Molecular Formula :
C49H57N11O6
Molecular Weight :
896.07

IUPAC Name:(2S)-N-(2-(3,5-dioxo-1,2-diphenyl-1,2,4-triazolidin-4-yl)ethyl)-5-guanidino-2-(2-(1-(2-oxo-2-(4-(6-oxo-6,11-dihydro-5H-dibenzo[b,e]azepin-11-yl)piperazin-1-yl)ethyl)cyclopentyl)acetamido)pentanamide

rel-BIIE-0246 structure diagram
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Product Information

Product Namerel-BIIE-0246
IUPAC Name(2S)-N-(2-(3,5-dioxo-1,2-diphenyl-1,2,4-triazolidin-4-yl)ethyl)-5-guanidino-2-(2-(1-(2-oxo-2-(4-(6-oxo-6,11-dihydro-5H-dibenzo[b,e]azepin-11-yl)piperazin-1-yl)ethyl)cyclopentyl)acetamido)pentanamide
Molecular FormulaC49H57N11O6
Molecular Weight896.07
SMILESO=C(N[C@H](C(NCCN1C(N(C2=CC=CC=C2)N(C3=CC=CC=C3)C1=O)=O)=O)CCCNC(N)=N)CC4(CC(N5CCN(C(C6=CC=CC=C67)C8=CC=CC=C8NC7=O)CC5)=O)CCCC4
InChI KeyRSJAXPUYVJKAAA-JPGJPTAESA-N
CAS No.2512225-05-5

Synthetic Route by SureRoute

1. ACEKCR892 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. ACEKCR892 route product structure diagram
    ACEKCR8922512225-05-5
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2. ACEKCR892 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. ACEKCR892 route product structure diagram
    ACEKCR8922512225-05-5
Inquiry

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