3-azabicyclo[2.2.0]hexane; 2-ethynyl-7-(2-methoxyethoxy)-N-(3-methoxy-4-phenoxy-phenyl)quinazolin-4-amine

Systemtic Name: 3-azabicyclo[2.2.0]hexane; 2-ethynyl-7-(2-methoxyethoxy)-N-(3-methoxy-4-phenoxy-phenyl)quinazolin-4-amine Openeye Name: 3-azabicyclo[2.2.0]hexane; 2-ethynyl-7-(2-methoxyethoxy)-N-(3-methoxy-4-phenoxy-phenyl)quinazolin-4-amine CAS Name: 3-azabicyclo[2.2.0]hexane; 2-ethynyl-7-(2-methoxyethoxy)-N-(3-methoxy-4-phenoxyphenyl)-4-quinazolinamine IUPAC Name: 3-azabicyclo[2.2.0]hexane; 2-ethynyl-7-(2-methoxyethoxy)-N-(3-methoxy-4-phenoxyphenyl)quinazolin-4-amine Traditional Name: 3-azabicyclo[2.2.0]hexane; [2-ethynyl-7-(2-methoxyethoxy)quinazolin-4-yl]-(3-methoxy-4-phenoxy-phenyl)amine Formula: C31H32N4O4 MolecularWeight: 524.61018

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC2=C(C=C1)C(=NC(=N2)C#C)NC3=CC(=C(C=C3)OC4=CC=CC=C4)OC.C1CC2C1CN2

Isomeric SMILES

COCCOC1=CC2=C(C=C1)C(=NC(=N2)C#C)NC3=CC(=C(C=C3)OC4=CC=CC=C4)OC.C1CC2C1CN2

InChI

InChI=1S/C26H23N3O4.C5H9N/c1-4-25-28-22-17-20(32-15-14-30-2)11-12-21(22)26(29-25)27-18-10-13-23(24(16-18)31-3)33-19-8-6-5-7-9-19;1-2-5-4(1)3-6-5/h1,5-13,16-17H,14-15H2,2-3H3,(H,27,28,29);4-6H,1-3H2