3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-pyrazol-4-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-pyrazol-4-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one Openeye Name: 3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-pyrazol-4-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one CAS Name: 3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-4-pyrazolyl]-1-(4-ethyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxypyrazol-4-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one Traditional Name: 3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-pyrazol-4-yl]-1-(4-ethylpiperazino)propan-1-one Formula: C26H31FN4O2 MolecularWeight: 450.548343

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CCC(=O)N2CCN(CC2)CC)OC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=NN(C(=C1CCC(=O)N2CCN(CC2)CC)OC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H31FN4O2/c1-3-24-23(14-15-25(32)30-18-16-29(4-2)17-19-30)26(33-22-8-6-5-7-9-22)31(28-24)21-12-10-20(27)11-13-21/h5-13H,3-4,14-19H2,1-2H3