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

Systemtic Name: N-(2-cyanophenyl)-4-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]piperazine-1-carboxamide Openeye Name: N-(2-cyanophenyl)-4-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]piperazine-1-carboxamide CAS Name: N-(2-cyanophenyl)-4-[[5-(3-fluorophenyl)-2-benzofuranyl]methyl]-1-piperazinecarboxamide IUPAC Name: N-(2-cyanophenyl)-4-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]piperazine-1-carboxamide Traditional Name: N-(2-cyanophenyl)-4-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]piperazine-1-carboxamide Formula: C27H23FN4O2 MolecularWeight: 454.495523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(O2)C=CC(=C3)C4=CC(=CC=C4)F)C(=O)NC5=CC=CC=C5C#N

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(O2)C=CC(=C3)C4=CC(=CC=C4)F)C(=O)NC5=CC=CC=C5C#N

InChI

InChI=1S/C27H23FN4O2/c28-23-6-3-5-19(15-23)20-8-9-26-22(14-20)16-24(34-26)18-31-10-12-32(13-11-31)27(33)30-25-7-2-1-4-21(25)17-29/h1-9,14-16H,10-13,18H2,(H,30,33)