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

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-(4-morpholinosulfonylphenyl)acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-[4-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(4-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-(4-morpholinosulfonylphenyl)acetamide Formula: C29H37N3O6S2 MolecularWeight: 587.75058

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C29H37N3O6S2/c1-39(34,35)32(26-6-2-24(3-7-26)29-17-21-14-22(18-29)16-23(15-21)19-29)20-28(33)30-25-4-8-27(9-5-25)40(36,37)31-10-12-38-13-11-31/h2-9,21-23H,10-20H2,1H3,(H,30,33)