N-(3-fluoranyl-4-isoquinolin-5-yloxy-phenyl)-4-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: N-(3-fluoranyl-4-isoquinolin-5-yloxy-phenyl)-4-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-[3-fluoro-4-(5-isoquinolyloxy)phenyl]-4-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-[3-fluoro-4-(5-isoquinolinyloxy)phenyl]-4-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-(3-fluoro-4-isoquinolin-5-yloxyphenyl)-4-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [3-fluoro-4-(5-isoquinolyloxy)phenyl]-[4-(trifluoromethyl)pyrimidin-2-yl]amine Formula: C20H12F4N4O MolecularWeight: 400.329093

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)OC3=C(C=C(C=C3)NC4=NC=CC(=N4)C(F)(F)F)F

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)OC3=C(C=C(C=C3)NC4=NC=CC(=N4)C(F)(F)F)F

InChI

InChI=1S/C20H12F4N4O/c21-15-10-13(27-19-26-9-7-18(28-19)20(22,23)24)4-5-17(15)29-16-3-1-2-12-11-25-8-6-14(12)16/h1-11H,(H,26,27,28)