BACE1-IN-6

Catalog No. :
ACIJVZ522
CAS No. :
2079945-75-6
Molecular Formula :
C25H23F2N5O2S
Molecular Weight :
495.55

IUPAC Name:6-((Z)-2-(3-((1S,5S,6S)-3-amino-5-methyl-1-(morpholine-4-carbonyl)-2-thia-4-azabicyclo[4.1.0]hept-3-en-5-yl)-4-fluorophenyl)-1-fluorovinyl)nicotinonitrile

BACE1-IN-6 structure diagram
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Product Information

Product NameBACE1-IN-6
IUPAC Name6-((Z)-2-(3-((1S,5S,6S)-3-amino-5-methyl-1-(morpholine-4-carbonyl)-2-thia-4-azabicyclo[4.1.0]hept-3-en-5-yl)-4-fluorophenyl)-1-fluorovinyl)nicotinonitrile
Molecular FormulaC25H23F2N5O2S
Molecular Weight495.55
SMILESN#CC1=CN=C(/C(F)=C/C2=CC=C(F)C([C@@]3(C)N=C(N)S[C@@]4(C(N5CCOCC5)=O)C[C@@]34[H])=C2)C=C1
InChI KeyVZHFJCNPAIRJSA-MYMUPAQMSA-N
Synonym3-Pyridinecarbonitrile, 6-[(1Z)-2-[3-[(1S,5S,6S)-3-amino-5-methyl-1-(4-morpholinylcarbonyl)-2-thia-4-azabicyclo[4.1.0]hept-3-en-5-yl]-4-fluorophenyl]-1-fluoroethenyl]-;BACE1-IN-6;Compound 15
CAS No.2079945-75-6

Synthetic Route by SureRoute

1. ACIJVZ522 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Then
  3. ACIJVZ522 route product structure diagram
    ACIJVZ5222079945-75-6
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2. ACIJVZ522 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. ACIJVZ522 route product structure diagram
    ACIJVZ5222079945-75-6
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