2-[4-[[2,6-bis(fluoranyl)-4-pyridin-4-yl-phenoxy]methyl]piperidin-1-yl]-5-ethyl-pyrimidine

Systemtic Name: 2-[4-[[2,6-bis(fluoranyl)-4-pyridin-4-yl-phenoxy]methyl]piperidin-1-yl]-5-ethyl-pyrimidine Openeye Name: 2-[4-[[2,6-difluoro-4-(4-pyridyl)phenoxy]methyl]-1-piperidyl]-5-ethyl-pyrimidine CAS Name: 2-[4-[(2,6-difluoro-4-pyridin-4-ylphenoxy)methyl]-1-piperidinyl]-5-ethylpyrimidine IUPAC Name: 2-[4-[(2,6-difluoro-4-pyridin-4-ylphenoxy)methyl]piperidin-1-yl]-5-ethylpyrimidine Traditional Name: 2-[4-[[2,6-difluoro-4-(4-pyridyl)phenoxy]methyl]piperidino]-5-ethyl-pyrimidine Formula: C23H24F2N4O MolecularWeight: 410.459666

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(N=C1)N2CCC(CC2)COC3=C(C=C(C=C3F)C4=CC=NC=C4)F

Isomeric SMILES

CCC1=CN=C(N=C1)N2CCC(CC2)COC3=C(C=C(C=C3F)C4=CC=NC=C4)F

InChI

InChI=1S/C23H24F2N4O/c1-2-16-13-27-23(28-14-16)29-9-5-17(6-10-29)15-30-22-20(24)11-19(12-21(22)25)18-3-7-26-8-4-18/h3-4,7-8,11-14,17H,2,5-6,9-10,15H2,1H3