Chemical Compound

SCHEMBL2329008

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SCHEMBL2329008 chemical structure
Primary Record

SCHEMBL2329008

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
53357095
SMILES
CC(C)(C)C[C@H]1[C@]([C@H]([C@@H](N1)C(=O)NCC2=CC(=C(C=C2)C(=O)OC)F)C3=C(C(=CC=C3)Cl)F)(C#N)C4=C(C=C(C=C4)Cl)F
Canonical SMILES
COC(=O)c1ccc(CNC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@](C#N)(c3ccc(Cl)cc3F)[C@H]2c2cccc(Cl)c2F)cc1F

Names & Synonyms

  • SCHEMBL2329008
  • KNFDTAZQCQDLMG-ULWUHOHFSA-N
  • rac-4-({[(2r,3s,4r,5s)-4-(4-chloro-2-fluoro-phenyl)-3-(3-chloro-2-fluoro-phenyl)-4-cyano-5-(2,2-dimethyl-propyl)-pyrrolidine-2-carbonyl]-amino}-methyl)-2-fluoro-benzoic acid methyl ester