ethyl 4-[6-[5-(4-fluorophenyl)pyridin-3-yl]-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-[5-(4-fluorophenyl)pyridin-3-yl]-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[6-[5-(4-fluorophenyl)-3-pyridyl]-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-phenyl-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-[5-(4-fluorophenyl)pyridin-3-yl]-2-phenylpyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[6-[5-(4-fluorophenyl)-3-pyridyl]-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxylic acid ethyl ester Formula: C28H26FN5O2 MolecularWeight: 483.536743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C3=CN=CC(=C3)C4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C3=CN=CC(=C3)C4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C28H26FN5O2/c1-2-36-28(35)34-14-12-33(13-15-34)26-17-25(31-27(32-26)21-6-4-3-5-7-21)23-16-22(18-30-19-23)20-8-10-24(29)11-9-20/h3-11,16-19H,2,12-15H2,1H3