1-[4-[4-(2,5-diphenylpyrazol-3-yl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]ethanone

Systemtic Name: 1-[4-[4-(2,5-diphenylpyrazol-3-yl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]ethanone Openeye Name: 1-[4-[4-(2,5-diphenylpyrazole-3-carbonyl)piperazin-1-yl]-3-fluoro-phenyl]ethanone CAS Name: 1-[4-[4-[(2,5-diphenyl-3-pyrazolyl)-oxomethyl]-1-piperazinyl]-3-fluorophenyl]ethanone IUPAC Name: 1-[4-[4-(2,5-diphenylpyrazole-3-carbonyl)piperazin-1-yl]-3-fluorophenyl]ethanone Traditional Name: 1-[4-[4-(2,5-diphenylpyrazole-3-carbonyl)piperazino]-3-fluoro-phenyl]ethanone Formula: C28H25FN4O2 MolecularWeight: 468.522103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CC=C5)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CC=C5)F

InChI

InChI=1S/C28H25FN4O2/c1-20(34)22-12-13-26(24(29)18-22)31-14-16-32(17-15-31)28(35)27-19-25(21-8-4-2-5-9-21)30-33(27)23-10-6-3-7-11-23/h2-13,18-19H,14-17H2,1H3