7-fluoranyl-3-(4-methoxy-3-pyrimidin-5-yl-phenyl)-3-[2-(trifluoromethyl)pyridin-4-yl]isoindol-1-amine

Systemtic Name: 7-fluoranyl-3-(4-methoxy-3-pyrimidin-5-yl-phenyl)-3-[2-(trifluoromethyl)pyridin-4-yl]isoindol-1-amine Openeye Name: 7-fluoro-3-(4-methoxy-3-pyrimidin-5-yl-phenyl)-3-[2-(trifluoromethyl)-4-pyridyl]isoindol-1-amine CAS Name: 7-fluoro-3-[4-methoxy-3-(5-pyrimidinyl)phenyl]-3-[2-(trifluoromethyl)-4-pyridinyl]-1-isoindolamine IUPAC Name: 7-fluoro-3-(4-methoxy-3-pyrimidin-5-ylphenyl)-3-[2-(trifluoromethyl)pyridin-4-yl]isoindol-1-amine Traditional Name: [7-fluoro-3-[4-methoxy-3-(5-pyrimidyl)phenyl]-3-[2-(trifluoromethyl)-4-pyridyl]isoindol-1-yl]amine Formula: C25H17F4N5O MolecularWeight: 479.428993

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H17F4N5O/c1-35-20-6-5-15(9-17(20)14-11-31-13-32-12-14)24(16-7-8-33-21(10-16)25(27,28)29)18-3-2-4-19(26)22(18)23(30)34-24/h2-13H,1H3,(H2,30,34)