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

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-[(4-ethoxyphenyl)methyl]ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-[(4-ethoxyphenyl)methyl]acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-[(4-ethoxyphenyl)methyl]acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-[(4-ethoxyphenyl)methyl]acetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-(4-ethoxybenzyl)acetamide Formula: C28H36N2O4S MolecularWeight: 496.66144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC(=O)CN(C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC(=O)CN(C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)S(=O)(=O)C

InChI

InChI=1S/C28H36N2O4S/c1-3-34-26-10-4-20(5-11-26)18-29-27(31)19-30(35(2,32)33)25-8-6-24(7-9-25)28-15-21-12-22(16-28)14-23(13-21)17-28/h4-11,21-23H,3,12-19H2,1-2H3,(H,29,31)