1-[1-(3-chloranyl-4-fluoranyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-cyclopropylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 1-[1-(3-chloranyl-4-fluoranyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-cyclopropylcarbonylpiperazin-1-yl)ethanone Openeye Name: 1-[1-(3-chloro-4-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]ethanone CAS Name: 1-[1-(3-chloro-4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]ethanone IUPAC Name: 1-[1-(3-chloro-4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]ethanone Traditional Name: 1-[1-(3-chloro-4-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-[4-(cyclopropanecarbonyl)piperazino]ethanone Formula: C22H25ClFN3O2 MolecularWeight: 417.904203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)F)Cl)C)C(=O)CN3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)F)Cl)C)C(=O)CN3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C22H25ClFN3O2/c1-14-11-18(15(2)27(14)17-5-6-20(24)19(23)12-17)21(28)13-25-7-9-26(10-8-25)22(29)16-3-4-16/h5-6,11-12,16H,3-4,7-10,13H2,1-2H3