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

Systemtic Name: N-(2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanamide Openeye Name: N-(2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]propanamide CAS Name: N-(2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]propanamide IUPAC Name: N-(2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanamide Traditional Name: N-(2-adamantyl)-2-methyl-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]propionamide Formula: C24H33F3N4O MolecularWeight: 450.54023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1C2CC3CC(C2)CC1C3)N4CCN(CC4)C5=NC=C(C=C5)C(F)(F)F

Isomeric SMILES

CC(C)(C(=O)NC1C2CC3CC(C2)CC1C3)N4CCN(CC4)C5=NC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C24H33F3N4O/c1-23(2,22(32)29-21-17-10-15-9-16(12-17)13-18(21)11-15)31-7-5-30(6-8-31)20-4-3-19(14-28-20)24(25,26)27/h3-4,14-18,21H,5-13H2,1-2H3,(H,29,32)