N-(3-chloranyl-4-fluoranyl-phenyl)-7-ethoxy-6-(oxan-4-yloxy)quinazolin-2-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-7-ethoxy-6-(oxan-4-yloxy)quinazolin-2-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-7-ethoxy-6-tetrahydropyran-4-yloxy-quinazolin-2-amine CAS Name: N-(3-chloro-4-fluorophenyl)-7-ethoxy-6-(4-oxanyloxy)-2-quinazolinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-7-ethoxy-6-(oxan-4-yloxy)quinazolin-2-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-(7-ethoxy-6-tetrahydropyran-4-yloxy-quinazolin-2-yl)amine Formula: C21H21ClFN3O3 MolecularWeight: 417.861143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C=NC(=NC2=C1)NC3=CC(=C(C=C3)F)Cl)OC4CCOCC4

Isomeric SMILES

CCOC1=C(C=C2C=NC(=NC2=C1)NC3=CC(=C(C=C3)F)Cl)OC4CCOCC4

InChI

InChI=1S/C21H21ClFN3O3/c1-2-28-19-11-18-13(9-20(19)29-15-5-7-27-8-6-15)12-24-21(26-18)25-14-3-4-17(23)16(22)10-14/h3-4,9-12,15H,2,5-8H2,1H3,(H,24,25,26)