
 MLS001124200

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M  END

>  <Chemical Name>
MLS001124200

>  <PubChem CID>
20911667

>  <Formula>
C20H28N2O3S

>  <Molecular Weight>
376.515000

>  <IUPAC Name>
cyclobutyl-[2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-2,3-dihydroindol-1-yl]methanone

>  <XlogP>
3.2

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CC1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(C3)C)C(=O)C4CCC4

>  <Isomeric SMILES>
CC1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(C3)C)C(=O)C4CCC4

>  <InChI Std. ID>
InChI=1S/C20H28N2O3S/c1-14-6-3-4-11-21(14)26(24,25)18-9-10-19-17(13-18)12-15(2)22(19)20(23)16-7-5-8-16/h9-10,13-16H,3-8,11-12H2,1-2H3

>  <InChI Key>
ABOAOLATMYDQNI-UHFFFAOYSA-N

