
 N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-2-ethoxybenzamide

 52 54  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-2-ethoxybenzamide

>  <PubChem CID>
1234706

>  <Formula>
C21H22N4O4S

>  <Molecular Weight>
426.491000

>  <IUPAC Name>
N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-2-ethoxybenzamide

>  <XlogP>
3.0

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
7

>  <Canonical SMILES>
CCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC(=CC(=N3)C)C

>  <Isomeric SMILES>
CCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC(=CC(=N3)C)C

>  <InChI Std. ID>
InChI=1S/C21H22N4O4S/c1-4-29-19-8-6-5-7-18(19)20(26)24-16-9-11-17(12-10-16)30(27,28)25-21-22-14(2)13-15(3)23-21/h5-13H,4H2,1-3H3,(H,24,26)(H,22,23,25)

>  <InChI Key>
AAAQITMOTRAMTE-UHFFFAOYSA-N

