
 CHEMBL2440468

 57 59  0  0  0  0  0  0  0  0999 V2000
    1.2130   -3.6620   -7.8021 C   0  0  0  0  0
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    0.2563   -4.0134   -7.4069 H   0  0  0  0  0
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    1.2866    0.5832   -3.1522 H   0  0  0  0  0
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  1 32  1  0  0  0
  1 33  1  0  0  0
  2  6  1  0  0  0
  2  3  2  0  0  0
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  9 35  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL2440468

>  <PubChem CID>
9954759

>  <Formula>
C19H27N5O5S

>  <Molecular Weight>
437.515000

>  <IUPAC Name>
[1-[2-(methanesulfonamido)ethyl]piperidin-4-yl]methyl N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]carbamate

>  <XlogP>
1.7

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
9

>  <Canonical SMILES>
CC1=NOC(=N1)C2=CC=CC=C2NC(=O)OCC3CCN(CC3)CCNS(=O)(=O)C

>  <Isomeric SMILES>
CC1=NOC(=N1)C2=CC=CC=C2NC(=O)OCC3CCN(CC3)CCNS(=O)(=O)C

>  <InChI Std. ID>
InChI=1S/C19H27N5O5S/c1-14-21-18(29-23-14)16-5-3-4-6-17(16)22-19(25)28-13-15-7-10-24(11-8-15)12-9-20-30(2,26)27/h3-6,15,20H,7-13H2,1-2H3,(H,22,25)

>  <InChI Key>
AYAHZTBEGZFJCD-UHFFFAOYSA-N

