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

Systemtic Name: 1-[4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]butan-2-ol Openeye Name: 1-[4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]butan-2-ol CAS Name: 1-[4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-phenyl-4-pyrimidinyl]-1-piperazinyl]-2-butanol IUPAC Name: 1-[4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-phenylpyrimidin-4-yl]piperazin-1-yl]butan-2-ol Traditional Name: 1-[4-[6-ethyl-5-(2-fluorobenzyl)-2-phenyl-pyrimidin-4-yl]piperazino]butan-2-ol Formula: C27H33FN4O MolecularWeight: 448.575523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33FN4O/c1-3-22(33)19-31-14-16-32(17-15-31)27-23(18-21-12-8-9-13-24(21)28)25(4-2)29-26(30-27)20-10-6-5-7-11-20/h5-13,22,33H,3-4,14-19H2,1-2H3