N-phenyl-1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanoyl]piperidine-3-carboxamide

Systemtic Name: N-phenyl-1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanoyl]piperidine-3-carboxamide Openeye Name: N-phenyl-1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)acetyl]piperidine-3-carboxamide CAS Name: 1-[1-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: N-phenyl-1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)acetyl]piperidine-3-carboxamide Traditional Name: N-phenyl-1-[2-[4-(2-pyrimidyl)piperazino]acetyl]nipecotamide Formula: C22H28N6O2 MolecularWeight: 408.49672

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CN2CCN(CC2)C3=NC=CC=N3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)C(=O)CN2CCN(CC2)C3=NC=CC=N3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H28N6O2/c29-20(17-26-12-14-27(15-13-26)22-23-9-5-10-24-22)28-11-4-6-18(16-28)21(30)25-19-7-2-1-3-8-19/h1-3,5,7-10,18H,4,6,11-17H2,(H,25,30)