1-[4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]propan-1-one

Systemtic Name: 1-[4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]propan-1-one CAS Name: 1-[4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-phenyl-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-phenylpyrimidin-4-yl]piperazin-1-yl]propan-1-one Traditional Name: 1-[4-[6-ethyl-5-(2-fluorobenzyl)-2-phenyl-pyrimidin-4-yl]piperazino]propan-1-one Formula: C26H29FN4O MolecularWeight: 432.533063

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)CC)CC4=CC=CC=C4F

Isomeric SMILES

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)CC)CC4=CC=CC=C4F

InChI

InChI=1S/C26H29FN4O/c1-3-23-21(18-20-12-8-9-13-22(20)27)26(29-25(28-23)19-10-6-5-7-11-19)31-16-14-30(15-17-31)24(32)4-2/h5-13H,3-4,14-18H2,1-2H3