
 CHEMBL3895675

 59 62  0  0  0  0  0  0  0  0999 V2000
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  1 33  1  0  0  0
  1 34  1  0  0  0
  1 35  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL3895675

>  <PubChem CID>
51034335

>  <Formula>
C25H27F3N2O2

>  <Molecular Weight>
444.498000

>  <IUPAC Name>
N-[3-cyclopropyl-5-(trifluoromethyl)phenyl]-1-(2-methylphenyl)-5-oxo-3-propan-2-ylpyrrolidine-3-carboxamide

>  <XlogP>
5.1

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CC1=CC=CC=C1N2CC(CC2=O)(C(C)C)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C4CC4

>  <Isomeric SMILES>
CC1=CC=CC=C1N2CC(CC2=O)(C(C)C)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C4CC4

>  <InChI Std. ID>
InChI=1S/C25H27F3N2O2/c1-15(2)24(13-22(31)30(14-24)21-7-5-4-6-16(21)3)23(32)29-20-11-18(17-8-9-17)10-19(12-20)25(26,27)28/h4-7,10-12,15,17H,8-9,13-14H2,1-3H3,(H,29,32)

>  <InChI Key>
CKLVWSHQIWEHNI-UHFFFAOYSA-N

