Chemical Compound

SCHEMBL15772677

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SCHEMBL15772677 chemical structure
Primary Record

SCHEMBL15772677

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
86722328
SMILES
CC[C@@]12CCC(=O)C[C@H]1CCCC3=C2C=C4C=NN(C4=C3)C5=CC=C(C=C5)F.CC[C@]12CCC(=O)C[C@@H]1CCCC3=C2C=C4C=NN(C4=C3)C5=CC=C(C=C5)F
Canonical SMILES
CC[C@@]12CCC(=O)C[C@H]1CCCc1cc3c(cnn3-c3ccc(F)cc3)cc12.CC[C@]12CCC(=O)C[C@@H]1CCCc1cc3c(cnn3-c3ccc(F)cc3)cc12

Names & Synonyms

  • SCHEMBL15772677
  • DFDIYPYVUPOUSR-ACIMWYPCSA-N
  • (4aR,12bR)-12b-ethyl-9-(4-fluorophenyl)-1,2,4a,5,6,7,9,12b-octahydro-4H-9,10-diaza-benzo[3,4]cyclohepta[1,2-f]inden-3-one; compound with (4aS,12bS)-12b-ethyl-9-(4-fluoro-phenyl)-1,2,4a,5,6,7,9,12b-octahydro-4H-9,10-diaza-benzo[3,4]cyclohepta[1,2-f]inden-3-one