2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-(3-phenylpropyl)acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(3-phenylpropyl)acetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-(3-phenylpropyl)acetamide Formula: C28H36N2O3S MolecularWeight: 480.66204

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCCC1=CC=CC=C1)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCCC1=CC=CC=C1)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H36N2O3S/c1-34(32,33)30(20-27(31)29-13-5-8-21-6-3-2-4-7-21)26-11-9-25(10-12-26)28-17-22-14-23(18-28)16-24(15-22)19-28/h2-4,6-7,9-12,22-24H,5,8,13-20H2,1H3,(H,29,31)