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

Systemtic Name: 1-[4-[6-ethyl-5-[(3-fluorophenyl)methyl]-2-methyl-pyrimidin-4-yl]piperazin-1-yl]-3-methyl-butan-2-ol Openeye Name: 1-[4-[6-ethyl-5-[(3-fluorophenyl)methyl]-2-methyl-pyrimidin-4-yl]piperazin-1-yl]-3-methyl-butan-2-ol CAS Name: 1-[4-[6-ethyl-5-[(3-fluorophenyl)methyl]-2-methyl-4-pyrimidinyl]-1-piperazinyl]-3-methyl-2-butanol IUPAC Name: 1-[4-[6-ethyl-5-[(3-fluorophenyl)methyl]-2-methylpyrimidin-4-yl]piperazin-1-yl]-3-methylbutan-2-ol Traditional Name: 1-[4-[6-ethyl-5-(3-fluorobenzyl)-2-methyl-pyrimidin-4-yl]piperazino]-3-methyl-butan-2-ol Formula: C23H33FN4O MolecularWeight: 400.532723

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(C(C)C)O)CC3=CC(=CC=C3)F

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(C(C)C)O)CC3=CC(=CC=C3)F

InChI

InChI=1S/C23H33FN4O/c1-5-21-20(14-18-7-6-8-19(24)13-18)23(26-17(4)25-21)28-11-9-27(10-12-28)15-22(29)16(2)3/h6-8,13,16,22,29H,5,9-12,14-15H2,1-4H3