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

Systemtic Name: 2-(4-propoxyphenoxy)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(4-propoxyphenoxy)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(4-propoxyphenoxy)-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]acetamide IUPAC Name: 2-(4-propoxyphenoxy)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(4-propoxyphenoxy)-N-[3-[4-(2-pyrimidyl)piperazino]propyl]acetamide Formula: C22H31N5O3 MolecularWeight: 413.51324

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OCC(=O)NCCCN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCCOC1=CC=C(C=C1)OCC(=O)NCCCN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C22H31N5O3/c1-2-17-29-19-5-7-20(8-6-19)30-18-21(28)23-11-4-12-26-13-15-27(16-14-26)22-24-9-3-10-25-22/h3,5-10H,2,4,11-18H2,1H3,(H,23,28)