2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-mesityl-acetamide Formula: C28H36N2O3S MolecularWeight: 480.66204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36N2O3S/c1-18-9-19(2)27(20(3)10-18)29-26(31)17-30(34(4,32)33)25-7-5-24(6-8-25)28-14-21-11-22(15-28)13-23(12-21)16-28/h5-10,21-23H,11-17H2,1-4H3,(H,29,31)