KRASG12CIN-2

Catalog No. :
ACGELT721
CAS No. :
2706637-12-7
Molecular Formula :
C32H35F6N7O3
Molecular Weight :
679.67

IUPAC Name:2-((S)-4-((R)-7-(3-amino-2-fluoro-5-methyl-6-(trifluoromethyl)phenyl)-2-(((2R,7aS)-2-fluorotetrahydro-1H-pyrrolizin-7a(5H)-yl)methoxy)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)-1-(2-fluoroacryloyl)piperazin-2-yl)acetonitrile

KRASG12CIN-2 structure diagram
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Product Information

Product NameKRASG12CIN-2
IUPAC Name2-((S)-4-((R)-7-(3-amino-2-fluoro-5-methyl-6-(trifluoromethyl)phenyl)-2-(((2R,7aS)-2-fluorotetrahydro-1H-pyrrolizin-7a(5H)-yl)methoxy)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)-1-(2-fluoroacryloyl)piperazin-2-yl)acetonitrile
Molecular FormulaC32H35F6N7O3
Molecular Weight679.67
SMILESN#CC[C@@H]1N(C(C(F)=C)=O)CCN(C2=C(CO[C@@H](C3=C(C(F)(F)F)C(C)=CC(N)=C3F)C4)C4=NC(OC[C@@]56CCCN5C[C@H](F)C6)=N2)C1
InChI KeyJOLORSRKBHXPFT-KIQNBNRRSA-N
Synonym(2S)-4-[(7R)-7-[3-Amino-2-fluoro-5-methyl-6-(trifluoromethyl)phenyl]-2-[[(2R,7aS)-2-fluorotetrahydro-1H-pyrrolizin-7a(5H)-yl]methoxy]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]-1-(2-fluoro-1-oxo-2-propen-1-yl)-2-piperazineacetonitrile;(7R)-D3S-001
CAS No.2706637-12-7

Synthetic Route by SureRoute

1. ACGELT721 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACGELT721 route product structure diagram
    ACGELT7212706637-12-7
Inquiry

2. ACGELT721 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. ACGELT721 route product structure diagram
    ACGELT7212706637-12-7
Inquiry

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