N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(4-ethanoylphenoxy)ethanamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(4-ethanoylphenoxy)ethanamide Openeye Name: 2-(4-acetylphenoxy)-N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]acetamide CAS Name: 2-(4-acetylphenoxy)-N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]acetamide IUPAC Name: 2-(4-acetylphenoxy)-N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]acetamide Traditional Name: 2-(4-acetylphenoxy)-N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]acetamide Formula: C22H28N4O4 MolecularWeight: 412.48212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3

InChI

InChI=1S/C22H28N4O4/c1-17(27)18-6-8-19(9-7-18)30-15-21(28)23-10-13-29-22-14-20(24-16-25-22)26-11-4-2-3-5-12-26/h6-9,14,16H,2-5,10-13,15H2,1H3,(H,23,28)