2-(4-fluorophenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-1-benzofuran-3-yl]ethanamide

Systemtic Name: 2-(4-fluorophenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-1-benzofuran-3-yl]ethanamide Openeye Name: 2-(4-fluorophenyl)-N-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)benzofuran-3-yl]acetamide CAS Name: 2-(4-fluorophenyl)-N-[2-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-3-benzofuranyl]acetamide IUPAC Name: 2-(4-fluorophenyl)-N-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-1-benzofuran-3-yl]acetamide Traditional Name: 2-(4-fluorophenyl)-N-[2-[4-(2-pyrimidyl)piperazine-1-carbonyl]benzofuran-3-yl]acetamide Formula: C25H22FN5O3 MolecularWeight: 459.472283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C4=CC=CC=C4O3)NC(=O)CC5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C4=CC=CC=C4O3)NC(=O)CC5=CC=C(C=C5)F

InChI

InChI=1S/C25H22FN5O3/c26-18-8-6-17(7-9-18)16-21(32)29-22-19-4-1-2-5-20(19)34-23(22)24(33)30-12-14-31(15-13-30)25-27-10-3-11-28-25/h1-11H,12-16H2,(H,29,32)