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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)CC(C(C)C)O)CC4=CC=C(C=C4)F

Isomeric SMILES

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)CC(C(C)C)O)CC4=CC=C(C=C4)F

InChI

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