N-[[4-[1-(4-sulfamoylphenyl)ethylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[1-(4-sulfamoylphenyl)ethylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[1-(4-sulfamoylphenyl)ethylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[oxo-[1-(4-sulfamoylphenyl)ethylamino]methyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[1-(4-sulfamoylphenyl)ethylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-[1-(4-sulfamoylphenyl)ethylcarbamoyl]benzyl]adamantane-1-carboxamide Formula: C27H33N3O4S MolecularWeight: 495.63362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)N)NC(=O)C2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)N)NC(=O)C2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H33N3O4S/c1-17(22-6-8-24(9-7-22)35(28,33)34)30-25(31)23-4-2-18(3-5-23)16-29-26(32)27-13-19-10-20(14-27)12-21(11-19)15-27/h2-9,17,19-21H,10-16H2,1H3,(H,29,32)(H,30,31)(H2,28,33,34)