2-(4-cyclopropylcarbonylpiperazin-1-yl)-1-[1-[(4-fluorophenyl)methyl]-2,5-dimethyl-pyrrol-3-yl]ethanone

Systemtic Name: 2-(4-cyclopropylcarbonylpiperazin-1-yl)-1-[1-[(4-fluorophenyl)methyl]-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-1-[1-[(4-fluorophenyl)methyl]-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-1-[1-[(4-fluorophenyl)methyl]-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-1-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-[4-(cyclopropanecarbonyl)piperazino]-1-[1-(4-fluorobenzyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C23H28FN3O2 MolecularWeight: 397.485723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=C(C=C2)F)C)C(=O)CN3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=C(C=C2)F)C)C(=O)CN3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C23H28FN3O2/c1-16-13-21(17(2)27(16)14-18-3-7-20(24)8-4-18)22(28)15-25-9-11-26(12-10-25)23(29)19-5-6-19/h3-4,7-8,13,19H,5-6,9-12,14-15H2,1-2H3