Chemical Compound

CHEMBL5902888

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CHEMBL5902888 chemical structure
Primary Record

CHEMBL5902888

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
146047190
SMILES
C[C@@H]1[C@H](CN([C@@H]1C(=O)OC(C)(C)C)C(=O)[C@H](C(C)(C)C)NC(=O)O[C@@H]2C[C@@H]3C[C@@H]3[C@H]2CCC=C)OC4=NC5=C(C=CC(=C5)OC)N=C4C(C=C)(F)F
Canonical SMILES
C=CCC[C@@H]1[C@H]2C[C@H]2C[C@H]1OC(=O)N[C@H](C(=O)N1C[C@H](Oc2nc3cc(OC)ccc3nc2C(F)(F)C=C)[C@@H](C)[C@H]1C(=O)OC(C)(C)C)C(C)(C)C

Names & Synonyms

  • CHEMBL5902888
  • BDBM403652
  • US10335409, Example 62
  • (1aS,2aR,6S,9S,10S,11R,23aR,23bS)-6-tert-butyl-N-[(1R,2R)-1-[(cyclopropylsulfonyl)carbamoyl]-2-(difluoromethyl)cyclopropyl]-19,19-difluoro-15-methoxy-10-methyl-4,7-dioxo-1a,2,2a,4,5,6,7,10,11,19,20,21,22,23,23a,23b-hexadecahydro-1H,9H-8,11-methanocyclopropa[4',5']cyclopenta[1',2':18,19][1,10,3,6]dioxadiazacyclononadecino[11,12-b]quinoxaline-9-carboxamide