2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-[4-(diethylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-[4-(diethylsulfamoyl)phenyl]ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-[4-(diethylsulfamoyl)phenyl]acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-[4-(diethylsulfamoyl)phenyl]acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-[4-(diethylsulfamoyl)phenyl]acetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-[4-(diethylsulfamoyl)phenyl]acetamide Formula: C29H39N3O5S2 MolecularWeight: 573.76706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H39N3O5S2/c1-4-31(5-2)39(36,37)27-12-8-25(9-13-27)30-28(33)20-32(38(3,34)35)26-10-6-24(7-11-26)29-17-21-14-22(18-29)16-23(15-21)19-29/h6-13,21-23H,4-5,14-20H2,1-3H3,(H,30,33)