2-(3-bromanyl-1-adamantyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-yl-phenyl]ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-yl-phenyl]ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-[5-(diethylsulfamoyl)-2-morpholino-phenyl]acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-[5-(diethylsulfamoyl)-2-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-[5-(diethylsulfamoyl)-2-morpholino-phenyl]acetamide Formula: C26H38BrN3O4S MolecularWeight: 568.56662

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C26H38BrN3O4S/c1-3-30(4-2)35(32,33)21-5-6-23(29-7-9-34-10-8-29)22(12-21)28-24(31)17-25-13-19-11-20(14-25)16-26(27,15-19)18-25/h5-6,12,19-20H,3-4,7-11,13-18H2,1-2H3,(H,28,31)