N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-ylphenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[5-(diethylsulfamoyl)-2-pyrrolidino-phenyl]-4-morpholino-3-nitro-benzamide Formula: C25H33N5O6S MolecularWeight: 531.62442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C25H33N5O6S/c1-3-29(4-2)37(34,35)20-8-10-22(27-11-5-6-12-27)21(18-20)26-25(31)19-7-9-23(24(17-19)30(32)33)28-13-15-36-16-14-28/h7-10,17-18H,3-6,11-16H2,1-2H3,(H,26,31)