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

Systemtic Name: 1-[4-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone Openeye Name: 1-[4-[(4-fluorophenyl)methyl-(2-thienylmethyl)amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone CAS Name: 1-[4-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-[oxo(1-piperazinyl)methyl]-1-pyrrolidinyl]ethanone IUPAC Name: 1-[4-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone Traditional Name: 1-[4-[(4-fluorobenzyl)-(2-thenyl)amino]-2-(piperazine-1-carbonyl)pyrrolidino]ethanone Formula: C23H29FN4O2S MolecularWeight: 444.565363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)N2CCNCC2)N(CC3=CC=C(C=C3)F)CC4=CC=CS4

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)N2CCNCC2)N(CC3=CC=C(C=C3)F)CC4=CC=CS4

InChI

InChI=1S/C23H29FN4O2S/c1-17(29)28-15-20(13-22(28)23(30)26-10-8-25-9-11-26)27(16-21-3-2-12-31-21)14-18-4-6-19(24)7-5-18/h2-7,12,20,22,25H,8-11,13-16H2,1H3