N-(3-fluorophenyl)-4-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]piperazine-1-carboxamide

Systemtic Name: N-(3-fluorophenyl)-4-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]piperazine-1-carboxamide Openeye Name: N-(3-fluorophenyl)-4-[[5-(p-tolyl)benzofuran-2-yl]methyl]piperazine-1-carboxamide CAS Name: N-(3-fluorophenyl)-4-[[5-(4-methylphenyl)-2-benzofuranyl]methyl]-1-piperazinecarboxamide IUPAC Name: N-(3-fluorophenyl)-4-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]piperazine-1-carboxamide Traditional Name: N-(3-fluorophenyl)-4-[[5-(p-tolyl)benzofuran-2-yl]methyl]piperazine-1-carboxamide Formula: C27H26FN3O2 MolecularWeight: 443.512643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)CN4CCN(CC4)C(=O)NC5=CC(=CC=C5)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)CN4CCN(CC4)C(=O)NC5=CC(=CC=C5)F

InChI

InChI=1S/C27H26FN3O2/c1-19-5-7-20(8-6-19)21-9-10-26-22(15-21)16-25(33-26)18-30-11-13-31(14-12-30)27(32)29-24-4-2-3-23(28)17-24/h2-10,15-17H,11-14,18H2,1H3,(H,29,32)