
 SCHEMBL1604237

 56 58  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
SCHEMBL1604237

>  <PubChem CID>
51034451

>  <Formula>
C24H24F3N3O2

>  <Molecular Weight>
443.470000

>  <IUPAC Name>
(3R)-N-[3-cyano-5-(trifluoromethyl)phenyl]-1-(2,6-dimethylphenyl)-5-oxo-3-propan-2-ylpyrrolidine-3-carboxamide

>  <XlogP>
4.3

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
6

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

>  <Isomeric SMILES>
CC1=C(C(=CC=C1)C)N2C[C@@](CC2=O)(C(C)C)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C#N

>  <InChI Std. ID>
InChI=1S/C24H24F3N3O2/c1-14(2)23(11-20(31)30(13-23)21-15(3)6-5-7-16(21)4)22(32)29-19-9-17(12-28)8-18(10-19)24(25,26)27/h5-10,14H,11,13H2,1-4H3,(H,29,32)/t23-/m0/s1

>  <InChI Key>
CQIOBGAMEQMMPD-QHCPKHFHSA-N

