2-(1-adamantyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(1-adamantyl)-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[3-[4-(2-pyrimidyl)piperazino]propyl]acetamide Formula: C23H35N5O MolecularWeight: 397.5569

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)CC23CC4CC(C2)CC(C4)C3)C5=NC=CC=N5

Isomeric SMILES

C1CN(CCN1CCCNC(=O)CC23CC4CC(C2)CC(C4)C3)C5=NC=CC=N5

InChI

InChI=1S/C23H35N5O/c29-21(17-23-14-18-11-19(15-23)13-20(12-18)16-23)24-5-2-6-27-7-9-28(10-8-27)22-25-3-1-4-26-22/h1,3-4,18-20H,2,5-17H2,(H,24,29)