4-fluoranyl-N3-[4-(1H-indol-5-yloxy)pyrimidin-2-yl]benzene-1,3-diamine; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 4-fluoranyl-N3-[4-(1H-indol-5-yloxy)pyrimidin-2-yl]benzene-1,3-diamine; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 4-fluoro-N3-[4-(1H-indol-5-yloxy)pyrimidin-2-yl]benzene-1,3-diamine; 2,2,2-trifluoroacetic acid CAS Name: 4-fluoro-N3-[4-(1H-indol-5-yloxy)-2-pyrimidinyl]benzene-1,3-diamine; 2,2,2-trifluoroacetic acid IUPAC Name: 4-fluoro-3-N-[4-(1H-indol-5-yloxy)pyrimidin-2-yl]benzene-1,3-diamine; 2,2,2-trifluoroacetic acid Traditional Name: (5-amino-2-fluoro-phenyl)-[4-(1H-indol-5-yloxy)pyrimidin-2-yl]amine; 2,2,2-trifluoroacetic acid Formula: C20H15F4N5O3 MolecularWeight: 449.358413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)NC2=NC=CC(=N2)OC3=CC4=C(C=C3)NC=C4)F.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1=CC(=C(C=C1N)NC2=NC=CC(=N2)OC3=CC4=C(C=C3)NC=C4)F.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C18H14FN5O.C2HF3O2/c19-14-3-1-12(20)10-16(14)23-18-22-8-6-17(24-18)25-13-2-4-15-11(9-13)5-7-21-15;3-2(4,5)1(6)7/h1-10,21H,20H2,(H,22,23,24);(H,6,7)