
 CHEMBL3973464

 59 61  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL3973464

>  <PubChem CID>
51034791

>  <Formula>
C24H24F6N2O3

>  <Molecular Weight>
502.457000

>  <IUPAC Name>
N-[3,5-bis(trifluoromethyl)phenyl]-1-[2-(hydroxymethyl)-6-methylphenyl]-5-oxo-3-propan-2-ylpyrrolidine-3-carboxamide

>  <XlogP>
4.2

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
9

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

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

>  <InChI Std. ID>
InChI=1S/C24H24F6N2O3/c1-13(2)22(10-19(34)32(12-22)20-14(3)5-4-6-15(20)11-33)21(35)31-18-8-16(23(25,26)27)7-17(9-18)24(28,29)30/h4-9,13,33H,10-12H2,1-3H3,(H,31,35)

>  <InChI Key>
JYUZZLGHXNFIIM-UHFFFAOYSA-N

