
 SCHEMBL1602444

 63 66  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
SCHEMBL1602444

>  <PubChem CID>
51034678

>  <Formula>
C26H26F6N2O3

>  <Molecular Weight>
528.495000

>  <IUPAC Name>
N-[3,5-bis(trifluoromethyl)phenyl]-1-(2,6-dimethylphenyl)-3-(oxan-4-yl)-5-oxopyrrolidine-3-carboxamide

>  <XlogP>
4.7

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
9

>  <Canonical SMILES>
CC1=C(C(=CC=C1)C)N2CC(CC2=O)(C3CCOCC3)C(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

>  <Isomeric SMILES>
CC1=C(C(=CC=C1)C)N2CC(CC2=O)(C3CCOCC3)C(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

>  <InChI Std. ID>
InChI=1S/C26H26F6N2O3/c1-15-4-3-5-16(2)22(15)34-14-24(13-21(34)35,17-6-8-37-9-7-17)23(36)33-20-11-18(25(27,28)29)10-19(12-20)26(30,31)32/h3-5,10-12,17H,6-9,13-14H2,1-2H3,(H,33,36)

>  <InChI Key>
HMYARADSDJEBHS-UHFFFAOYSA-N

