N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(4-ethanoyl-2-methoxy-phenoxy)ethanamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(4-ethanoyl-2-methoxy-phenoxy)ethanamide Openeye Name: 2-(4-acetyl-2-methoxy-phenoxy)-N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]acetamide CAS Name: 2-(4-acetyl-2-methoxyphenoxy)-N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]acetamide IUPAC Name: 2-(4-acetyl-2-methoxyphenoxy)-N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]acetamide Traditional Name: 2-(4-acetyl-2-methoxy-phenoxy)-N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]acetamide Formula: C23H30N4O5 MolecularWeight: 442.5081

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O5/c1-17(28)18-7-8-19(20(13-18)30-2)32-15-22(29)24-9-12-31-23-14-21(25-16-26-23)27-10-5-3-4-6-11-27/h7-8,13-14,16H,3-6,9-12,15H2,1-2H3,(H,24,29)