Chemical Compound

Adagrasib

CAS Registry Number 2326521-71-3
Adagrasib chemical structure
Primary Record

Adagrasib

In stock
6,804 g
Purity
99.8 %
CAS
2326521-71-3

Compound Identifiers & Properties

CAS
2326521-71-3
PubChem CID
155321704
SMILES
CN1CCCC1COC2=NC3=C(CCN(C3)C4=CC=CC5=C4C(=CC=C5)Cl)C(=N2)N6CCN(C(C6)CC#N)C(=O)C(=C)F
Canonical SMILES
C=C(F)C(=O)N1CCN(c2nc(OCC3CCCN3C)nc3c2CCN(c2cccc4cccc(Cl)c24)C3)CC1CC#N

Names & Synonyms

  • Adagrasib
  • SCHEMBL22692010
  • SCHEMBL30008196
  • 2326521-71-3
  • 2-[(2S)-4-[7-(8-chloronaphthalen-1-yl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile
  • 2-[(2S)-4-[7-(8-chloronaphthalen-1-yl)-2-{[(2S)-1-methylpyrrolidin-2-yl]methoxy}-5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile