(5S,7R)-N-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-phenyl]-3-oxidanyl-adamantane-1-carboxamide

Systemtic Name: (5S,7R)-N-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-phenyl]-3-oxidanyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-N-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-phenyl]-3-hydroxy-adamantane-1-carboxamide CAS Name: (5S,7R)-N-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methylphenyl]-3-hydroxy-1-adamantanecarboxamide IUPAC Name: (5S,7R)-N-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methylphenyl]-3-hydroxyadamantane-1-carboxamide Traditional Name: (5S,7R)-N-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-phenyl]-3-hydroxy-adamantane-1-carboxamide Formula: C26H32N2O4S MolecularWeight: 468.60828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)NC(=O)C34CC5CC(C3)CC(C5)(C4)O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)NC(=O)C34C[C@H]5C[C@@H](C3)CC(C5)(C4)O)C)C

InChI

InChI=1S/C26H32N2O4S/c1-16-4-7-22(18(3)8-16)28-33(31,32)23-10-21(6-5-17(23)2)27-24(29)25-11-19-9-20(12-25)14-26(30,13-19)15-25/h4-8,10,19-20,28,30H,9,11-15H2,1-3H3,(H,27,29)/t19-,20+,25?,26?