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

Systemtic Name: N-(5-methanoyl-2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanamide Openeye Name: N-(5-formyl-2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]propanamide CAS Name: N-(5-formyl-2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]propanamide IUPAC Name: N-(5-formyl-2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanamide Traditional Name: N-(5-formyl-2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]propionamide Formula: C25H33F3N4O2 MolecularWeight: 478.55033

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1C2CC3CC1CC(C3)(C2)C=O)N4CCN(CC4)C5=NC=C(C=C5)C(F)(F)F

Isomeric SMILES

CC(C)(C(=O)NC1C2CC3CC1CC(C3)(C2)C=O)N4CCN(CC4)C5=NC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C25H33F3N4O2/c1-23(2,22(34)30-21-17-9-16-10-18(21)13-24(11-16,12-17)15-33)32-7-5-31(6-8-32)20-4-3-19(14-29-20)25(26,27)28/h3-4,14-18,21H,5-13H2,1-2H3,(H,30,34)