1-[2-(1,4-diazepan-1-ylcarbonyl)-4-[(4-fluorophenyl)methyl-phenethyl-amino]pyrrolidin-1-yl]ethanone

Systemtic Name: 1-[2-(1,4-diazepan-1-ylcarbonyl)-4-[(4-fluorophenyl)methyl-phenethyl-amino]pyrrolidin-1-yl]ethanone Openeye Name: 1-[2-(1,4-diazepane-1-carbonyl)-4-[(4-fluorophenyl)methyl-phenethyl-amino]pyrrolidin-1-yl]ethanone CAS Name: 1-[2-[1,4-diazepan-1-yl(oxo)methyl]-4-[(4-fluorophenyl)methyl-phenethylamino]-1-pyrrolidinyl]ethanone IUPAC Name: 1-[2-(1,4-diazepane-1-carbonyl)-4-[(4-fluorophenyl)methyl-phenethylamino]pyrrolidin-1-yl]ethanone Traditional Name: 1-[2-(1,4-diazepane-1-carbonyl)-4-[(4-fluorobenzyl)-phenethyl-amino]pyrrolidino]ethanone Formula: C27H35FN4O2 MolecularWeight: 466.590803

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)N2CCCNCC2)N(CCC3=CC=CC=C3)CC4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)N2CCCNCC2)N(CCC3=CC=CC=C3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C27H35FN4O2/c1-21(33)32-20-25(18-26(32)27(34)30-15-5-13-29-14-17-30)31(16-12-22-6-3-2-4-7-22)19-23-8-10-24(28)11-9-23/h2-4,6-11,25-26,29H,5,12-20H2,1H3