(5S,7R)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-3-oxidanyl-adamantane-1-carboxamide

Systemtic Name: (5S,7R)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-3-oxidanyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-3-hydroxy-adamantane-1-carboxamide CAS Name: (5S,7R)-N-[3-(diethylsulfamoyl)-4-methylphenyl]-3-hydroxy-1-adamantanecarboxamide IUPAC Name: (5S,7R)-N-[3-(diethylsulfamoyl)-4-methylphenyl]-3-hydroxyadamantane-1-carboxamide Traditional Name: (5S,7R)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-3-hydroxy-adamantane-1-carboxamide Formula: C22H32N2O4S MolecularWeight: 420.56548

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C23CC4CC(C2)CC(C4)(C3)O)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)O)C

InChI

InChI=1S/C22H32N2O4S/c1-4-24(5-2)29(27,28)19-9-18(7-6-15(19)3)23-20(25)21-10-16-8-17(11-21)13-22(26,12-16)14-21/h6-7,9,16-17,26H,4-5,8,10-14H2,1-3H3,(H,23,25)/t16-,17+,21?,22?