1-[4-[(4-fluorophenyl)methyl-(2-methylpropyl)amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone

Systemtic Name: 1-[4-[(4-fluorophenyl)methyl-(2-methylpropyl)amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone Openeye Name: 1-[4-[(4-fluorophenyl)methyl-isobutyl-amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone CAS Name: 1-[4-[(4-fluorophenyl)methyl-(2-methylpropyl)amino]-2-[oxo(1-piperazinyl)methyl]-1-pyrrolidinyl]ethanone IUPAC Name: 1-[4-[(4-fluorophenyl)methyl-(2-methylpropyl)amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone Traditional Name: 1-[4-[(4-fluorobenzyl)-isobutyl-amino]-2-(piperazine-1-carbonyl)pyrrolidino]ethanone Formula: C22H33FN4O2 MolecularWeight: 404.521423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=C(C=C1)F)C2CC(N(C2)C(=O)C)C(=O)N3CCNCC3

Isomeric SMILES

CC(C)CN(CC1=CC=C(C=C1)F)C2CC(N(C2)C(=O)C)C(=O)N3CCNCC3

InChI

InChI=1S/C22H33FN4O2/c1-16(2)13-26(14-18-4-6-19(23)7-5-18)20-12-21(27(15-20)17(3)28)22(29)25-10-8-24-9-11-25/h4-7,16,20-21,24H,8-15H2,1-3H3