2-ethynyl-N-(3-methyl-4-phenoxy-phenyl)quinazolin-4-amine; 6-oxa-3-azabicyclo[3.1.0]hexane

Systemtic Name: 2-ethynyl-N-(3-methyl-4-phenoxy-phenyl)quinazolin-4-amine; 6-oxa-3-azabicyclo[3.1.0]hexane Openeye Name: 2-ethynyl-N-(3-methyl-4-phenoxy-phenyl)quinazolin-4-amine; 6-oxa-3-azabicyclo[3.1.0]hexane CAS Name: 2-ethynyl-N-(3-methyl-4-phenoxyphenyl)-4-quinazolinamine; 6-oxa-3-azabicyclo[3.1.0]hexane IUPAC Name: 2-ethynyl-N-(3-methyl-4-phenoxyphenyl)quinazolin-4-amine; 6-oxa-3-azabicyclo[3.1.0]hexane Traditional Name: (2-ethynylquinazolin-4-yl)-(3-methyl-4-phenoxy-phenyl)amine; 6-oxa-3-azabicyclo[3.1.0]hexane Formula: C27H24N4O2 MolecularWeight: 436.50506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC(=NC3=CC=CC=C32)C#C)OC4=CC=CC=C4.C1C2C(O2)CN1

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC(=NC3=CC=CC=C32)C#C)OC4=CC=CC=C4.C1C2C(O2)CN1

InChI

InChI=1S/C23H17N3O.C4H7NO/c1-3-22-25-20-12-8-7-11-19(20)23(26-22)24-17-13-14-21(16(2)15-17)27-18-9-5-4-6-10-18;1-3-4(6-3)2-5-1/h1,4-15H,2H3,(H,24,25,26);3-5H,1-2H2