2-(3-bromanyl-1-adamantyl)-N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-[5-morpholinosulfonyl-2-(1-piperidyl)phenyl]acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-[5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)phenyl]acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-(5-morpholinosulfonyl-2-piperidino-phenyl)acetamide Formula: C27H38BrN3O4S MolecularWeight: 580.57732

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CC45CC6CC(C4)CC(C6)(C5)Br

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CC45CC6CC(C4)CC(C6)(C5)Br

InChI

InChI=1S/C27H38BrN3O4S/c28-27-16-20-12-21(17-27)15-26(14-20,19-27)18-25(32)29-23-13-22(36(33,34)31-8-10-35-11-9-31)4-5-24(23)30-6-2-1-3-7-30/h4-5,13,20-21H,1-3,6-12,14-19H2,(H,29,32)