(E)-1-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-yl]-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-en-1-one CAS Name: (E)-1-[4-(4-acetyl-2-fluorophenyl)-1-piperazinyl]-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-1-[4-(4-acetyl-2-fluorophenyl)piperazin-1-yl]-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-[4-(4-acetyl-2-fluoro-phenyl)piperazino]-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-en-1-one Formula: C29H26FN5O2 MolecularWeight: 495.547443

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C=CC3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)/C=C/C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)F

InChI

InChI=1S/C29H26FN5O2/c1-21(36)22-9-11-27(26(30)18-22)33-14-16-34(17-15-33)28(37)12-10-24-20-35(25-7-3-2-4-8-25)32-29(24)23-6-5-13-31-19-23/h2-13,18-20H,14-17H2,1H3/b12-10+