N-[5-(1,4-diazepan-1-ylcarbonyl)-2-[4-(3-fluorophenyl)carbonyl-1,4-diazepan-1-yl]phenyl]-2-(4-methoxyphenyl)ethanamide

Systemtic Name: N-[5-(1,4-diazepan-1-ylcarbonyl)-2-[4-(3-fluorophenyl)carbonyl-1,4-diazepan-1-yl]phenyl]-2-(4-methoxyphenyl)ethanamide Openeye Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]phenyl]-2-(4-methoxyphenyl)acetamide CAS Name: N-[5-[1,4-diazepan-1-yl(oxo)methyl]-2-[4-[(3-fluorophenyl)-oxomethyl]-1,4-diazepan-1-yl]phenyl]-2-(4-methoxyphenyl)acetamide IUPAC Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]phenyl]-2-(4-methoxyphenyl)acetamide Traditional Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]phenyl]-2-(4-methoxyphenyl)acetamide Formula: C33H38FN5O4 MolecularWeight: 587.684323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC2=C(C=CC(=C2)C(=O)N3CCCNCC3)N4CCCN(CC4)C(=O)C5=CC(=CC=C5)F

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC2=C(C=CC(=C2)C(=O)N3CCCNCC3)N4CCCN(CC4)C(=O)C5=CC(=CC=C5)F

InChI

InChI=1S/C33H38FN5O4/c1-43-28-10-7-24(8-11-28)21-31(40)36-29-23-26(33(42)38-15-3-13-35-14-18-38)9-12-30(29)37-16-4-17-39(20-19-37)32(41)25-5-2-6-27(34)22-25/h2,5-12,22-23,35H,3-4,13-21H2,1H3,(H,36,40)