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

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(2-morpholin-4-ylcarbonylphenyl)ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-[2-(morpholine-4-carbonyl)phenyl]acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-[2-[4-morpholinyl(oxo)methyl]phenyl]acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-[2-(morpholine-4-carbonyl)phenyl]acetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-[2-(morpholine-4-carbonyl)phenyl]acetamide Formula: C30H37N3O5S MolecularWeight: 551.69688

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)N2CCOCC2)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)N2CCOCC2)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C30H37N3O5S/c1-39(36,37)33(20-28(34)31-27-5-3-2-4-26(27)29(35)32-10-12-38-13-11-32)25-8-6-24(7-9-25)30-17-21-14-22(18-30)16-23(15-21)19-30/h2-9,21-23H,10-20H2,1H3,(H,31,34)