N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-(pyridin-4-ylmethylamino)ethanamide; ethanedioic acid

Systemtic Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-(pyridin-4-ylmethylamino)ethanamide; ethanedioic acid Openeye Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-(4-pyridylmethylamino)acetamide; oxalic acid CAS Name: N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-(pyridin-4-ylmethylamino)acetamide; oxalic acid IUPAC Name: N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-(pyridin-4-ylmethylamino)acetamide; oxalic acid Traditional Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-(4-pyridylmethylamino)acetamide; oxalic acid Formula: C19H24N4O7S MolecularWeight: 452.48146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CNCC2=CC=NC=C2)S(=O)(=O)N(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CNCC2=CC=NC=C2)S(=O)(=O)N(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H22N4O3S.C2H2O4/c1-13-4-5-15(10-16(13)25(23,24)21(2)3)20-17(22)12-19-11-14-6-8-18-9-7-14;3-1(4)2(5)6/h4-10,19H,11-12H2,1-3H3,(H,20,22);(H,3,4)(H,5,6)