3-[1-adamantylmethyl(methyl)amino]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[1-adamantylmethyl(methyl)amino]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-[1-adamantylmethyl(methyl)amino]-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-[1-adamantylmethyl(methyl)amino]-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[1-adamantylmethyl(methyl)amino]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[1-adamantylmethyl(methyl)amino]-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C24H36N4O MolecularWeight: 396.56884

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)N1CCN(CC1)C2=CC=CC=N2)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN(CCC(=O)N1CCN(CC1)C2=CC=CC=N2)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H36N4O/c1-26(18-24-15-19-12-20(16-24)14-21(13-19)17-24)7-5-23(29)28-10-8-27(9-11-28)22-4-2-3-6-25-22/h2-4,6,19-21H,5,7-18H2,1H3