7-fluoranyl-3-(2-methoxypyridin-4-yl)-3-(3-pyrimidin-5-ylphenyl)isoindol-1-amine

Systemtic Name: 7-fluoranyl-3-(2-methoxypyridin-4-yl)-3-(3-pyrimidin-5-ylphenyl)isoindol-1-amine Openeye Name: 7-fluoro-3-(2-methoxy-4-pyridyl)-3-(3-pyrimidin-5-ylphenyl)isoindol-1-amine CAS Name: 7-fluoro-3-(2-methoxy-4-pyridinyl)-3-[3-(5-pyrimidinyl)phenyl]-1-isoindolamine IUPAC Name: 7-fluoro-3-(2-methoxypyridin-4-yl)-3-(3-pyrimidin-5-ylphenyl)isoindol-1-amine Traditional Name: [7-fluoro-3-(2-methoxy-4-pyridyl)-3-[3-(5-pyrimidyl)phenyl]isoindol-1-yl]amine Formula: C24H18FN5O MolecularWeight: 411.431023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=CC(=C1)C2(C3=C(C(=CC=C3)F)C(=N2)N)C4=CC=CC(=C4)C5=CN=CN=C5

Isomeric SMILES

COC1=NC=CC(=C1)C2(C3=C(C(=CC=C3)F)C(=N2)N)C4=CC=CC(=C4)C5=CN=CN=C5

InChI

InChI=1S/C24H18FN5O/c1-31-21-11-18(8-9-29-21)24(19-6-3-7-20(25)22(19)23(26)30-24)17-5-2-4-15(10-17)16-12-27-14-28-13-16/h2-14H,1H3,(H2,26,30)