
 CHEMBL3263682

 78 83  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL3263682

>  <PubChem CID>
71234250

>  <Formula>
C32H37N5O4

>  <Molecular Weight>
555.679000

>  <IUPAC Name>
N-[2-[4-(2-methylphenyl)piperazin-1-yl]-5-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]phenyl]furan-2-carboxamide

>  <XlogP>
3.8

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
CC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCC(CC4)N5CCCC5=O)NC(=O)C6=CC=CO6

>  <Isomeric SMILES>
CC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCC(CC4)N5CCCC5=O)NC(=O)C6=CC=CO6

>  <InChI Std. ID>
InChI=1S/C32H37N5O4/c1-23-6-2-3-7-27(23)34-17-19-35(20-18-34)28-11-10-24(22-26(28)33-31(39)29-8-5-21-41-29)32(40)36-15-12-25(13-16-36)37-14-4-9-30(37)38/h2-3,5-8,10-11,21-22,25H,4,9,12-20H2,1H3,(H,33,39)

>  <InChI Key>
LFLZZQBWEOKBNS-UHFFFAOYSA-N

