N-[1-[(3,5-diethoxy-4-fluoranyl-phenyl)methyl]piperidin-4-yl]-5-pyridin-3-yl-pyrimidin-2-amine

Systemtic Name: N-[1-[(3,5-diethoxy-4-fluoranyl-phenyl)methyl]piperidin-4-yl]-5-pyridin-3-yl-pyrimidin-2-amine Openeye Name: N-[1-[(3,5-diethoxy-4-fluoro-phenyl)methyl]-4-piperidyl]-5-(3-pyridyl)pyrimidin-2-amine CAS Name: N-[1-[(3,5-diethoxy-4-fluorophenyl)methyl]-4-piperidinyl]-5-(3-pyridinyl)-2-pyrimidinamine IUPAC Name: N-[1-[(3,5-diethoxy-4-fluorophenyl)methyl]piperidin-4-yl]-5-pyridin-3-ylpyrimidin-2-amine Traditional Name: [1-(3,5-diethoxy-4-fluoro-benzyl)-4-piperidyl]-[5-(3-pyridyl)pyrimidin-2-yl]amine Formula: C25H30FN5O2 MolecularWeight: 451.536403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1F)OCC)CN2CCC(CC2)NC3=NC=C(C=N3)C4=CN=CC=C4

Isomeric SMILES

CCOC1=CC(=CC(=C1F)OCC)CN2CCC(CC2)NC3=NC=C(C=N3)C4=CN=CC=C4

InChI

InChI=1S/C25H30FN5O2/c1-3-32-22-12-18(13-23(24(22)26)33-4-2)17-31-10-7-21(8-11-31)30-25-28-15-20(16-29-25)19-6-5-9-27-14-19/h5-6,9,12-16,21H,3-4,7-8,10-11,17H2,1-2H3,(H,28,29,30)