N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-2-pyridin-2-ylsulfanyl-ethanamide; ethanedioic acid

Systemtic Name: N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-2-pyridin-2-ylsulfanyl-ethanamide; ethanedioic acid Openeye Name: N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-2-(2-pyridylsulfanyl)acetamide; oxalic acid CAS Name: N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-(2-pyridinylthio)acetamide; oxalic acid IUPAC Name: N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-pyridin-2-ylsulfanylacetamide; oxalic acid Traditional Name: N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-2-(2-pyridylthio)acetamide; oxalic acid Formula: C20H25N3O7S2 MolecularWeight: 483.5584

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=O)CSC2=CC=CC=N2.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=O)CSC2=CC=CC=N2.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H23N3O3S2.C2H2O4/c1-4-21(5-2)26(23,24)15-10-9-14(3)16(12-15)20-17(22)13-25-18-8-6-7-11-19-18;3-1(4)2(5)6/h6-12H,4-5,13H2,1-3H3,(H,20,22);(H,3,4)(H,5,6)