1-[4-[5-[(3-fluorophenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]hexan-2-ol

Systemtic Name: 1-[4-[5-[(3-fluorophenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]hexan-2-ol Openeye Name: 1-[4-[5-[(3-fluorophenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]hexan-2-ol CAS Name: 1-[4-[5-[(3-fluorophenyl)methyl]-6-methyl-2-phenyl-4-pyrimidinyl]-1-piperazinyl]-2-hexanol IUPAC Name: 1-[4-[5-[(3-fluorophenyl)methyl]-6-methyl-2-phenylpyrimidin-4-yl]piperazin-1-yl]hexan-2-ol Traditional Name: 1-[4-[5-(3-fluorobenzyl)-6-methyl-2-phenyl-pyrimidin-4-yl]piperazino]hexan-2-ol Formula: C28H35FN4O MolecularWeight: 462.602103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CN1CCN(CC1)C2=NC(=NC(=C2CC3=CC(=CC=C3)F)C)C4=CC=CC=C4)O

Isomeric SMILES

CCCCC(CN1CCN(CC1)C2=NC(=NC(=C2CC3=CC(=CC=C3)F)C)C4=CC=CC=C4)O

InChI

InChI=1S/C28H35FN4O/c1-3-4-13-25(34)20-32-14-16-33(17-15-32)28-26(19-22-9-8-12-24(29)18-22)21(2)30-27(31-28)23-10-6-5-7-11-23/h5-12,18,25,34H,3-4,13-17,19-20H2,1-2H3