1-[4-(4-fluoranylphenoxy)-3-(trifluoromethyl)phenyl]-1,3-dimethyl-3-[4-(1H-pyrazolo[3,4-b]pyridin-4-yloxy)phenyl]urea

Systemtic Name: 1-[4-(4-fluoranylphenoxy)-3-(trifluoromethyl)phenyl]-1,3-dimethyl-3-[4-(1H-pyrazolo[3,4-b]pyridin-4-yloxy)phenyl]urea Openeye Name: 1-[4-(4-fluorophenoxy)-3-(trifluoromethyl)phenyl]-1,3-dimethyl-3-[4-(1H-pyrazolo[3,4-b]pyridin-4-yloxy)phenyl]urea CAS Name: 1-[4-(4-fluorophenoxy)-3-(trifluoromethyl)phenyl]-1,3-dimethyl-3-[4-(1H-pyrazolo[3,4-b]pyridin-4-yloxy)phenyl]urea IUPAC Name: 1-[4-(4-fluorophenoxy)-3-(trifluoromethyl)phenyl]-1,3-dimethyl-3-[4-(1H-pyrazolo[3,4-b]pyridin-4-yloxy)phenyl]urea Traditional Name: 1-[4-(4-fluorophenoxy)-3-(trifluoromethyl)phenyl]-1,3-dimethyl-3-[4-(1H-pyrazolo[3,4-b]pyridin-4-yloxy)phenyl]urea Formula: C28H21F4N5O3 MolecularWeight: 551.491653

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC2=C3C=NNC3=NC=C2)C(=O)N(C)C4=CC(=C(C=C4)OC5=CC=C(C=C5)F)C(F)(F)F

Isomeric SMILES

CN(C1=CC=C(C=C1)OC2=C3C=NNC3=NC=C2)C(=O)N(C)C4=CC(=C(C=C4)OC5=CC=C(C=C5)F)C(F)(F)F

InChI

InChI=1S/C28H21F4N5O3/c1-36(18-5-10-21(11-6-18)39-24-13-14-33-26-22(24)16-34-35-26)27(38)37(2)19-7-12-25(23(15-19)28(30,31)32)40-20-8-3-17(29)4-9-20/h3-16H,1-2H3,(H,33,34,35)