N-[2-(azepan-1-ylcarbonyl)-1-benzofuran-3-yl]-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)-1-benzofuran-3-yl]-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[2-(azepane-1-carbonyl)benzofuran-3-yl]-5-(4-fluorophenyl)isoxazole-3-carboxamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]-3-benzofuranyl]-5-(4-fluorophenyl)-3-isoxazolecarboxamide IUPAC Name: N-[2-(azepane-1-carbonyl)-1-benzofuran-3-yl]-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide Traditional Name: N-[2-(azepane-1-carbonyl)benzofuran-3-yl]-5-(4-fluorophenyl)isoxazole-3-carboxamide Formula: C25H22FN3O4 MolecularWeight: 447.458283

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=NOC(=C4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=NOC(=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H22FN3O4/c26-17-11-9-16(10-12-17)21-15-19(28-33-21)24(30)27-22-18-7-3-4-8-20(18)32-23(22)25(31)29-13-5-1-2-6-14-29/h3-4,7-12,15H,1-2,5-6,13-14H2,(H,27,30)