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M  END

>  <Chemical Name>
MLS-0413763.0001

>  <PubChem CID>
16250706

>  <Formula>
C23H30N2O7S

>  <Molecular Weight>
478.560000

>  <IUPAC Name>
3-methoxy-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-4-(2-methylpropoxy)benzamide

>  <XlogP>
2.8

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
8

>  <Canonical SMILES>
CC(C)COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC)OC

>  <Isomeric SMILES>
CC(C)COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC)OC

>  <InChI Std. ID>
InChI=1S/C23H30N2O7S/c1-16(2)15-32-21-7-5-17(13-22(21)30-4)23(26)24-19-14-18(6-8-20(19)29-3)33(27,28)25-9-11-31-12-10-25/h5-8,13-14,16H,9-12,15H2,1-4H3,(H,24,26)

>  <InChI Key>
CFTMQROCQNRZNW-UHFFFAOYSA-N

