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

Systemtic Name: (5S,7R)-N-[4-chloranyl-3-(dimethylsulfamoyl)phenyl]-3-oxidanyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-hydroxy-adamantane-1-carboxamide CAS Name: (5S,7R)-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-hydroxy-1-adamantanecarboxamide IUPAC Name: (5S,7R)-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-hydroxyadamantane-1-carboxamide Traditional Name: (5S,7R)-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-hydroxy-adamantane-1-carboxamide Formula: C19H25ClN2O4S MolecularWeight: 412.9308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25ClN2O4S/c1-22(2)27(25,26)16-6-14(3-4-15(16)20)21-17(23)18-7-12-5-13(8-18)10-19(24,9-12)11-18/h3-4,6,12-13,24H,5,7-11H2,1-2H3,(H,21,23)/t12-,13+,18?,19?