N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-2-(3-morpholin-4-ylpropylamino)ethanamide; ethanedioic acid

Systemtic Name: N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-2-(3-morpholin-4-ylpropylamino)ethanamide; ethanedioic acid Openeye Name: N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-2-(3-morpholinopropylamino)acetamide; oxalic acid CAS Name: N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-[3-(4-morpholinyl)propylamino]acetamide; oxalic acid IUPAC Name: N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-(3-morpholin-4-ylpropylamino)acetamide; oxalic acid Traditional Name: N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-2-(3-morpholinopropylamino)acetamide; oxalic acid Formula: C22H36N4O8S MolecularWeight: 516.60824

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=O)CNCCCN2CCOCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=O)CNCCCN2CCOCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H34N4O4S.C2H2O4/c1-4-24(5-2)29(26,27)18-8-7-17(3)19(15-18)22-20(25)16-21-9-6-10-23-11-13-28-14-12-23;3-1(4)2(5)6/h7-8,15,21H,4-6,9-14,16H2,1-3H3,(H,22,25);(H,3,4)(H,5,6)