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M  END

>  <Chemical Name>
MLS-0418254.0001

>  <PubChem CID>
4878446

>  <Formula>
C19H24N2O5S2

>  <Molecular Weight>
424.530000

>  <IUPAC Name>
5-ethyl-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-4-methylthiophene-2-carboxamide

>  <XlogP>
2.7

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
7

>  <Canonical SMILES>
CCC1=C(C=C(S1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC)C

>  <Isomeric SMILES>
CCC1=C(C=C(S1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC)C

>  <InChI Std. ID>
InChI=1S/C19H24N2O5S2/c1-4-17-13(2)11-18(27-17)19(22)20-15-12-14(5-6-16(15)25-3)28(23,24)21-7-9-26-10-8-21/h5-6,11-12H,4,7-10H2,1-3H3,(H,20,22)

>  <InChI Key>
CPYIIHGSBLUWEM-UHFFFAOYSA-N

