4-azabicyclo[3.1.0]hexane; 2-ethynyl-N-(3-fluoranyl-4-pyridin-3-yloxy-phenyl)quinazolin-4-amine

Systemtic Name: 4-azabicyclo[3.1.0]hexane; 2-ethynyl-N-(3-fluoranyl-4-pyridin-3-yloxy-phenyl)quinazolin-4-amine Openeye Name: 4-azabicyclo[3.1.0]hexane; 2-ethynyl-N-[3-fluoro-4-(3-pyridyloxy)phenyl]quinazolin-4-amine CAS Name: 4-azabicyclo[3.1.0]hexane; 2-ethynyl-N-[3-fluoro-4-(3-pyridinyloxy)phenyl]-4-quinazolinamine IUPAC Name: 4-azabicyclo[3.1.0]hexane; 2-ethynyl-N-(3-fluoro-4-pyridin-3-yloxyphenyl)quinazolin-4-amine Traditional Name: 4-azabicyclo[3.1.0]hexane; (2-ethynylquinazolin-4-yl)-[3-fluoro-4-(3-pyridyloxy)phenyl]amine Formula: C26H22FN5O MolecularWeight: 439.484183

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=NC2=CC=CC=C2C(=N1)NC3=CC(=C(C=C3)OC4=CN=CC=C4)F.C1CNC2C1C2

Isomeric SMILES

C#CC1=NC2=CC=CC=C2C(=N1)NC3=CC(=C(C=C3)OC4=CN=CC=C4)F.C1CNC2C1C2

InChI

InChI=1S/C21H13FN4O.C5H9N/c1-2-20-25-18-8-4-3-7-16(18)21(26-20)24-14-9-10-19(17(22)12-14)27-15-6-5-11-23-13-15;1-2-6-5-3-4(1)5/h1,3-13H,(H,24,25,26);4-6H,1-3H2