1-[2-(5-bromanyl-2-fluoranyl-phenyl)-4-[3-(4-ethanoylpiperazin-1-yl)propyl]-4-phenyl-3H-pyrazol-5-yl]ethanone

Systemtic Name: 1-[2-(5-bromanyl-2-fluoranyl-phenyl)-4-[3-(4-ethanoylpiperazin-1-yl)propyl]-4-phenyl-3H-pyrazol-5-yl]ethanone Openeye Name: 1-[4-[3-(4-acetylpiperazin-1-yl)propyl]-2-(5-bromo-2-fluoro-phenyl)-4-phenyl-3H-pyrazol-5-yl]ethanone CAS Name: 1-[4-[3-(4-acetyl-1-piperazinyl)propyl]-2-(5-bromo-2-fluorophenyl)-4-phenyl-3H-pyrazol-5-yl]ethanone IUPAC Name: 1-[4-[3-(4-acetylpiperazin-1-yl)propyl]-2-(5-bromo-2-fluorophenyl)-4-phenyl-3H-pyrazol-5-yl]ethanone Traditional Name: 1-[4-[3-(4-acetylpiperazino)propyl]-1-(5-bromo-2-fluoro-phenyl)-4-phenyl-2-pyrazolin-3-yl]ethanone Formula: C26H30BrFN4O2 MolecularWeight: 529.444403

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(CC1(CCCN2CCN(CC2)C(=O)C)C3=CC=CC=C3)C4=C(C=CC(=C4)Br)F

Isomeric SMILES

CC(=O)C1=NN(CC1(CCCN2CCN(CC2)C(=O)C)C3=CC=CC=C3)C4=C(C=CC(=C4)Br)F

InChI

InChI=1S/C26H30BrFN4O2/c1-19(33)25-26(21-7-4-3-5-8-21,11-6-12-30-13-15-31(16-14-30)20(2)34)18-32(29-25)24-17-22(27)9-10-23(24)28/h3-5,7-10,17H,6,11-16,18H2,1-2H3