
 CHEMBL364398

 67 70  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL364398

>  <PubChem CID>
10137876

>  <Formula>
C23H37N3O3S

>  <Molecular Weight>
435.627000

>  <IUPAC Name>
2-[2,2-dioxo-1-[1-(4-propan-2-ylcyclohexyl)piperidin-4-yl]-4H-2$l^{6},1,3-benzothiadiazin-3-yl]ethanol

>  <XlogP>
3.3

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
CC(C)C1CCC(CC1)N2CCC(CC2)N3C4=CC=CC=C4CN(S3(=O)=O)CCO

>  <Isomeric SMILES>
CC(C)C1CCC(CC1)N2CCC(CC2)N3C4=CC=CC=C4CN(S3(=O)=O)CCO

>  <InChI Std. ID>
InChI=1S/C23H37N3O3S/c1-18(2)19-7-9-21(10-8-19)24-13-11-22(12-14-24)26-23-6-4-3-5-20(23)17-25(15-16-27)30(26,28)29/h3-6,18-19,21-22,27H,7-17H2,1-2H3

>  <InChI Key>
AEXLHDOOHWXDNZ-UHFFFAOYSA-N

