1-[4-[5-pyrrol-1-yl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[5-pyrrol-1-yl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[5-pyrrol-1-yl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[oxo-[5-(1-pyrrolyl)-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]methyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[5-pyrrol-1-yl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[5-pyrrol-1-yl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbonyl]piperazino]ethanone Formula: C21H20F3N5O2 MolecularWeight: 431.41101

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C(F)(F)F)N4C=CC=C4

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC(=C3)C(F)(F)F)N4C=CC=C4

InChI

InChI=1S/C21H20F3N5O2/c1-15(30)26-9-11-28(12-10-26)20(31)18-14-25-29(19(18)27-7-2-3-8-27)17-6-4-5-16(13-17)21(22,23)24/h2-8,13-14H,9-12H2,1H3