N-(5-oxidanyl-2-adamantyl)-1-(2-pyridin-2-ylethylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(5-oxidanyl-2-adamantyl)-1-(2-pyridin-2-ylethylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(5-hydroxy-2-adamantyl)-1-[2-(2-pyridyl)ethylsulfonyl]piperidine-4-carboxamide CAS Name: N-(5-hydroxy-2-adamantyl)-1-[2-(2-pyridinyl)ethylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(5-hydroxy-2-adamantyl)-1-(2-pyridin-2-ylethylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(5-hydroxy-2-adamantyl)-1-[2-(2-pyridyl)ethylsulfonyl]isonipecotamide Formula: C23H33N3O4S MolecularWeight: 447.59082

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2C3CC4CC2CC(C4)(C3)O)S(=O)(=O)CCC5=CC=CC=N5

Isomeric SMILES

C1CN(CCC1C(=O)NC2C3CC4CC2CC(C4)(C3)O)S(=O)(=O)CCC5=CC=CC=N5

InChI

InChI=1S/C23H33N3O4S/c27-22(25-21-18-11-16-12-19(21)15-23(28,13-16)14-18)17-4-8-26(9-5-17)31(29,30)10-6-20-3-1-2-7-24-20/h1-3,7,16-19,21,28H,4-6,8-15H2,(H,25,27)