(5S,7R)-3-chloranyl-N-[5-(diethylsulfamoyl)-2-ethoxy-phenyl]adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-chloranyl-N-[5-(diethylsulfamoyl)-2-ethoxy-phenyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-chloro-N-[5-(diethylsulfamoyl)-2-ethoxy-phenyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-chloro-N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-chloro-N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-chloro-N-[5-(diethylsulfamoyl)-2-ethoxy-phenyl]adamantane-1-carboxamide Formula: C23H33ClN2O4S MolecularWeight: 469.03712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33ClN2O4S/c1-4-26(5-2)31(28,29)18-7-8-20(30-6-3)19(10-18)25-21(27)22-11-16-9-17(12-22)14-23(24,13-16)15-22/h7-8,10,16-17H,4-6,9,11-15H2,1-3H3,(H,25,27)/t16-,17+,22?,23?