N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide CAS Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[4-(2-pyrimidyl)piperazino]acetamide Formula: C23H32N6O MolecularWeight: 408.53978

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)N(CCC#N)C23CC4CC(C2)CC(C4)C3)C5=NC=CC=N5

Isomeric SMILES

C1CN(CCN1CC(=O)N(CCC#N)C23CC4CC(C2)CC(C4)C3)C5=NC=CC=N5

InChI

InChI=1S/C23H32N6O/c24-3-1-6-29(23-14-18-11-19(15-23)13-20(12-18)16-23)21(30)17-27-7-9-28(10-8-27)22-25-4-2-5-26-22/h2,4-5,18-20H,1,6-17H2