2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-[(2-chlorophenyl)methyl]ethanamide

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-[(2-chlorophenyl)methyl]ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-[(2-chlorophenyl)methyl]acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-[(2-chlorophenyl)methyl]acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-[(2-chlorophenyl)methyl]acetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-(2-chlorobenzyl)acetamide Formula: C26H31ClN2O3S MolecularWeight: 487.05394

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCC1=CC=CC=C1Cl)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCC1=CC=CC=C1Cl)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H31ClN2O3S/c1-33(31,32)29(17-25(30)28-16-21-4-2-3-5-24(21)27)23-8-6-22(7-9-23)26-13-18-10-19(14-26)12-20(11-18)15-26/h2-9,18-20H,10-17H2,1H3,(H,28,30)