N4-(1H-indazol-5-yl)-N2-[3-(trifluoromethyloxy)phenyl]quinazoline-2,4-diamine

Systemtic Name: N4-(1H-indazol-5-yl)-N2-[3-(trifluoromethyloxy)phenyl]quinazoline-2,4-diamine Openeye Name: N4-(1H-indazol-5-yl)-N2-[3-(trifluoromethoxy)phenyl]quinazoline-2,4-diamine CAS Name: N4-(1H-indazol-5-yl)-N2-[3-(trifluoromethoxy)phenyl]quinazoline-2,4-diamine IUPAC Name: 4-N-(1H-indazol-5-yl)-2-N-[3-(trifluoromethoxy)phenyl]quinazoline-2,4-diamine Traditional Name: 1H-indazol-5-yl-[2-[3-(trifluoromethoxy)anilino]quinazolin-4-yl]amine Formula: C22H15F3N6O MolecularWeight: 436.38931

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)NC3=CC(=CC=C3)OC(F)(F)F)NC4=CC5=C(C=C4)NN=C5

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)NC3=CC(=CC=C3)OC(F)(F)F)NC4=CC5=C(C=C4)NN=C5

InChI

InChI=1S/C22H15F3N6O/c23-22(24,25)32-16-5-3-4-14(11-16)28-21-29-19-7-2-1-6-17(19)20(30-21)27-15-8-9-18-13(10-15)12-26-31-18/h1-12H,(H,26,31)(H2,27,28,29,30)