4-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[[5-(3-fluorophenyl)-2-benzofuranyl]methyl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide Formula: C28H28FN3O3 MolecularWeight: 473.538623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)N2CCCN(CC2)CC3=CC4=C(O3)C=CC(=C4)C5=CC(=CC=C5)F

Isomeric SMILES

COC1=CC=CC=C1NC(=O)N2CCCN(CC2)CC3=CC4=C(O3)C=CC(=C4)C5=CC(=CC=C5)F

InChI

InChI=1S/C28H28FN3O3/c1-34-27-9-3-2-8-25(27)30-28(33)32-13-5-12-31(14-15-32)19-24-18-22-16-21(10-11-26(22)35-24)20-6-4-7-23(29)17-20/h2-4,6-11,16-18H,5,12-15,19H2,1H3,(H,30,33)