2-(1-adamantyl)-N,N'-bis[3-(diethylsulfamoyl)phenyl]propanediamide

Systemtic Name: 2-(1-adamantyl)-N,N'-bis[3-(diethylsulfamoyl)phenyl]propanediamide Openeye Name: 2-(1-adamantyl)-N,N'-bis[3-(diethylsulfamoyl)phenyl]propanediamide CAS Name: 2-(1-adamantyl)-N,N'-bis[3-(diethylsulfamoyl)phenyl]propanediamide IUPAC Name: 2-(1-adamantyl)-N,N'-bis[3-(diethylsulfamoyl)phenyl]propanediamide Traditional Name: 2-(1-adamantyl)-N,N'-bis[3-(diethylsulfamoyl)phenyl]malonamide Formula: C33H46N4O6S2 MolecularWeight: 658.87154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=O)C(C(=O)NC2=CC(=CC=C2)S(=O)(=O)N(CC)CC)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=O)C(C(=O)NC2=CC(=CC=C2)S(=O)(=O)N(CC)CC)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C33H46N4O6S2/c1-5-36(6-2)44(40,41)28-13-9-11-26(18-28)34-31(38)30(33-20-23-15-24(21-33)17-25(16-23)22-33)32(39)35-27-12-10-14-29(19-27)45(42,43)37(7-3)8-4/h9-14,18-19,23-25,30H,5-8,15-17,20-22H2,1-4H3,(H,34,38)(H,35,39)