2-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperazin-2-yl]ethanol

Systemtic Name: 2-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperazin-2-yl]ethanol Openeye Name: 2-[1-[(2-fluoro-4-methoxy-phenyl)methyl]-4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperazin-2-yl]ethanol CAS Name: 2-[1-[(2-fluoro-4-methoxyphenyl)methyl]-4-[[1-(2-pyrimidinyl)-2-pyrrolyl]methyl]-2-piperazinyl]ethanol IUPAC Name: 2-[1-[(2-fluoro-4-methoxyphenyl)methyl]-4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperazin-2-yl]ethanol Traditional Name: 2-[1-(2-fluoro-4-methoxy-benzyl)-4-[[1-(2-pyrimidyl)pyrrol-2-yl]methyl]piperazin-2-yl]ethanol Formula: C23H28FN5O2 MolecularWeight: 425.499123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCN(CC2CCO)CC3=CC=CN3C4=NC=CC=N4)F

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCN(CC2CCO)CC3=CC=CN3C4=NC=CC=N4)F

InChI

InChI=1S/C23H28FN5O2/c1-31-21-6-5-18(22(24)14-21)15-28-12-11-27(16-19(28)7-13-30)17-20-4-2-10-29(20)23-25-8-3-9-26-23/h2-6,8-10,14,19,30H,7,11-13,15-17H2,1H3