N-(5-methoxy-7-oxidanyl-2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanamide

Systemtic Name: N-(5-methoxy-7-oxidanyl-2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanamide Openeye Name: N-(5-hydroxy-7-methoxy-2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]propanamide CAS Name: N-(5-hydroxy-7-methoxy-2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]propanamide IUPAC Name: N-(5-hydroxy-7-methoxy-2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanamide Traditional Name: N-(5-hydroxy-7-methoxy-2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]propionamide Formula: C25H35F3N4O3 MolecularWeight: 496.56561

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1C2CC3(CC1CC(C2)(C3)OC)O)N4CCN(CC4)C5=NC=C(C=C5)C(F)(F)F

Isomeric SMILES

CC(C)(C(=O)NC1C2CC3(CC1CC(C2)(C3)OC)O)N4CCN(CC4)C5=NC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C25H35F3N4O3/c1-22(2,32-8-6-31(7-9-32)19-5-4-18(14-29-19)25(26,27)28)21(33)30-20-16-10-23(34)11-17(20)13-24(12-16,15-23)35-3/h4-5,14,16-17,20,34H,6-13,15H2,1-3H3,(H,30,33)