
 MLS000585997

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M  END

>  <Chemical Name>
MLS000585997

>  <PubChem CID>
12005500

>  <Formula>
C22H24N2O3S2

>  <Molecular Weight>
428.565000

>  <IUPAC Name>
N-(2,6-diethylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide

>  <XlogP>
5.1

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CCC1=C(C(=CC=C1)CC)NC(=O)C(C2=CC=CC=C2)NS(=O)(=O)C3=CC=CS3

>  <Isomeric SMILES>
CCC1=C(C(=CC=C1)CC)NC(=O)C(C2=CC=CC=C2)NS(=O)(=O)C3=CC=CS3

>  <InChI Std. ID>
InChI=1S/C22H24N2O3S2/c1-3-16-12-8-13-17(4-2)20(16)23-22(25)21(18-10-6-5-7-11-18)24-29(26,27)19-14-9-15-28-19/h5-15,21,24H,3-4H2,1-2H3,(H,23,25)

>  <InChI Key>
AYDCGXFUTQPEON-UHFFFAOYSA-N

