5-(4-fluorophenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-1-benzofuran-3-yl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(4-fluorophenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-1-benzofuran-3-yl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(4-fluorophenyl)-N-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)benzofuran-3-yl]isoxazole-3-carboxamide CAS Name: 5-(4-fluorophenyl)-N-[2-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-3-benzofuranyl]-3-isoxazolecarboxamide IUPAC Name: 5-(4-fluorophenyl)-N-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-1-benzofuran-3-yl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(4-fluorophenyl)-N-[2-[4-(2-pyrimidyl)piperazine-1-carbonyl]benzofuran-3-yl]isoxazole-3-carboxamide Formula: C27H21FN6O4 MolecularWeight: 512.491843

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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)C5=NOC(=C5)C6=CC=C(C=C6)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C4=CC=CC=C4O3)NC(=O)C5=NOC(=C5)C6=CC=C(C=C6)F

InChI

InChI=1S/C27H21FN6O4/c28-18-8-6-17(7-9-18)22-16-20(32-38-22)25(35)31-23-19-4-1-2-5-21(19)37-24(23)26(36)33-12-14-34(15-13-33)27-29-10-3-11-30-27/h1-11,16H,12-15H2,(H,31,35)