
 CHEMBL3891249

 62 65  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL3891249

>  <PubChem CID>
51033450

>  <Formula>
C26H25F6N3O2

>  <Molecular Weight>
525.495000

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

>  <XlogP>
3.9

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
9

>  <Canonical SMILES>
CC1=C(C(=CC=C1)C)N2CC(CC2=O)(C3=CCNCC3)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)(C3=CCNCC3)C(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

>  <InChI Std. ID>
InChI=1S/C26H25F6N3O2/c1-15-4-3-5-16(2)22(15)35-14-24(13-21(35)36,17-6-8-33-9-7-17)23(37)34-20-11-18(25(27,28)29)10-19(12-20)26(30,31)32/h3-6,10-12,33H,7-9,13-14H2,1-2H3,(H,34,37)

>  <InChI Key>
DSYNTRLRWZXWNU-UHFFFAOYSA-N

