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

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(4-phenoxyphenyl)ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-(4-phenoxyphenyl)acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(4-phenoxyphenyl)acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(4-phenoxyphenyl)acetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-(4-phenoxyphenyl)acetamide Formula: C31H34N2O4S MolecularWeight: 530.67766

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C31H34N2O4S/c1-38(35,36)33(21-30(34)32-26-9-13-29(14-10-26)37-28-5-3-2-4-6-28)27-11-7-25(8-12-27)31-18-22-15-23(19-31)17-24(16-22)20-31/h2-14,22-24H,15-21H2,1H3,(H,32,34)