
 SCHEMBL1603112

 61 63  0  0  0  0  0  0  0  0999 V2000
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    4.0646   -4.5688    5.0574 H   0  0  0  0  0
    4.1301   -3.0051    1.2383 H   0  0  0  0  0
    3.6877   -1.3377    0.7810 H   0  0  0  0  0
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M  END

>  <Chemical Name>
SCHEMBL1603112

>  <PubChem CID>
51034997

>  <Formula>
C25H26F6N2O2

>  <Molecular Weight>
500.485000

>  <IUPAC Name>
N-[3,5-bis(trifluoromethyl)phenyl]-1-(2,6-dimethylphenyl)-3-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide

>  <XlogP>
5.8

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
8

>  <Canonical SMILES>
CC1=C(C(=CC=C1)C)N2CC(CC2=O)(CC(C)C)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

>  <Isomeric SMILES>
CC1=C(C(=CC=C1)C)N2CC(CC2=O)(CC(C)C)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

>  <InChI Std. ID>
InChI=1S/C25H26F6N2O2/c1-14(2)11-23(12-20(34)33(13-23)21-15(3)6-5-7-16(21)4)22(35)32-19-9-17(24(26,27)28)8-18(10-19)25(29,30)31/h5-10,14H,11-13H2,1-4H3,(H,32,35)

>  <InChI Key>
CKHXVJSQZDWIFD-UHFFFAOYSA-N

