2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-[2-(4-methoxyphenyl)ethyl]ethanamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)CN(C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)CN(C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)S(=O)(=O)C

InChI

InChI=1S/C28H36N2O4S/c1-34-26-9-3-20(4-10-26)11-12-29-27(31)19-30(35(2,32)33)25-7-5-24(6-8-25)28-16-21-13-22(17-28)15-23(14-21)18-28/h3-10,21-23H,11-19H2,1-2H3,(H,29,31)