1-[4-[(4-methylphenyl)methyl-phenethyl-amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone

Systemtic Name: 1-[4-[(4-methylphenyl)methyl-phenethyl-amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone Openeye Name: 1-[4-[phenethyl(p-tolylmethyl)amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone CAS Name: 1-[4-[(4-methylphenyl)methyl-phenethylamino]-2-[oxo(1-piperazinyl)methyl]-1-pyrrolidinyl]ethanone IUPAC Name: 1-[4-[(4-methylphenyl)methyl-phenethylamino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone Traditional Name: 1-[4-[(4-methylbenzyl)-phenethyl-amino]-2-(piperazine-1-carbonyl)pyrrolidino]ethanone Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C)C(=O)N4CCNCC4

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C)C(=O)N4CCNCC4

InChI

InChI=1S/C27H36N4O2/c1-21-8-10-24(11-9-21)19-30(15-12-23-6-4-3-5-7-23)25-18-26(31(20-25)22(2)32)27(33)29-16-13-28-14-17-29/h3-11,25-26,28H,12-20H2,1-2H3