(E)-3-(2-fluorophenyl)-1-[3-(5-phenyl-2-pyridin-4-yl-pyrimidin-4-yl)piperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(2-fluorophenyl)-1-[3-(5-phenyl-2-pyridin-4-yl-pyrimidin-4-yl)piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(2-fluorophenyl)-1-[3-[5-phenyl-2-(4-pyridyl)pyrimidin-4-yl]-1-piperidyl]prop-2-en-1-one CAS Name: (E)-3-(2-fluorophenyl)-1-[3-(5-phenyl-2-pyridin-4-yl-4-pyrimidinyl)-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-3-(2-fluorophenyl)-1-[3-(5-phenyl-2-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(2-fluorophenyl)-1-[3-[5-phenyl-2-(4-pyridyl)pyrimidin-4-yl]piperidino]prop-2-en-1-one Formula: C29H25FN4O MolecularWeight: 464.533403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C=CC2=CC=CC=C2F)C3=NC(=NC=C3C4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

C1CC(CN(C1)C(=O)/C=C/C2=CC=CC=C2F)C3=NC(=NC=C3C4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C29H25FN4O/c30-26-11-5-4-9-22(26)12-13-27(35)34-18-6-10-24(20-34)28-25(21-7-2-1-3-8-21)19-32-29(33-28)23-14-16-31-17-15-23/h1-5,7-9,11-17,19,24H,6,10,18,20H2/b13-12+