2-(diethylamino)-N-[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]-5-nitro-benzamide

Systemtic Name: 2-(diethylamino)-N-[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]-5-nitro-benzamide Openeye Name: 2-(diethylamino)-N-[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]-5-nitro-benzamide CAS Name: 2-(diethylamino)-N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-5-nitrobenzamide IUPAC Name: 2-(diethylamino)-N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-5-nitrobenzamide Traditional Name: 2-(diethylamino)-N-[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]-5-nitro-benzamide Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=C(C(=CC(=C2)S(=O)(=O)N(C)C)C)C

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=C(C(=CC(=C2)S(=O)(=O)N(C)C)C)C

InChI

InChI=1S/C21H28N4O5S/c1-7-24(8-2)20-10-9-16(25(27)28)12-18(20)21(26)22-19-13-17(11-14(3)15(19)4)31(29,30)23(5)6/h9-13H,7-8H2,1-6H3,(H,22,26)