2-[(5S,7R)-3-methyl-1-adamantyl]-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]ethanamide

Systemtic Name: 2-[(5S,7R)-3-methyl-1-adamantyl]-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-[(5S,7R)-3-methyl-1-adamantyl]-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]acetamide CAS Name: 2-[(5S,7R)-3-methyl-1-adamantyl]-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]acetamide IUPAC Name: 2-[(5S,7R)-3-methyl-1-adamantyl]-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-[(5S,7R)-3-methyl-1-adamantyl]-N-[3-[4-(2-pyrimidyl)piperazino]propyl]acetamide Formula: C24H37N5O MolecularWeight: 411.58348

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)CC(C3)(C2)CC(=O)NCCCN4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC12C[C@H]3C[C@@H](C1)CC(C3)(C2)CC(=O)NCCCN4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C24H37N5O/c1-23-13-19-12-20(14-23)16-24(15-19,18-23)17-21(30)25-6-3-7-28-8-10-29(11-9-28)22-26-4-2-5-27-22/h2,4-5,19-20H,3,6-18H2,1H3,(H,25,30)/t19-,20+,23?,24?