N-[5-(diethylsulfamoyl)-2-morpholin-4-yl-phenyl]-2-(methylamino)-5-nitro-benzamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-morpholin-4-yl-phenyl]-2-(methylamino)-5-nitro-benzamide Openeye Name: N-[5-(diethylsulfamoyl)-2-morpholino-phenyl]-2-(methylamino)-5-nitro-benzamide CAS Name: N-[5-(diethylsulfamoyl)-2-(4-morpholinyl)phenyl]-2-(methylamino)-5-nitrobenzamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-(methylamino)-5-nitrobenzamide Traditional Name: N-[5-(diethylsulfamoyl)-2-morpholino-phenyl]-2-(methylamino)-5-nitro-benzamide Formula: C22H29N5O6S MolecularWeight: 491.56056

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC

InChI

InChI=1S/C22H29N5O6S/c1-4-26(5-2)34(31,32)17-7-9-21(25-10-12-33-13-11-25)20(15-17)24-22(28)18-14-16(27(29)30)6-8-19(18)23-3/h6-9,14-15,23H,4-5,10-13H2,1-3H3,(H,24,28)