N-(3-chloranyl-4-fluoranyl-phenyl)-7-(2-methoxyethoxy)-5-(oxan-4-yloxy)quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-7-(2-methoxyethoxy)-5-(oxan-4-yloxy)quinazolin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-7-(2-methoxyethoxy)-5-tetrahydropyran-4-yloxy-quinazolin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-7-(2-methoxyethoxy)-5-(4-oxanyloxy)-4-quinazolinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-7-(2-methoxyethoxy)-5-(oxan-4-yloxy)quinazolin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-[7-(2-methoxyethoxy)-5-tetrahydropyran-4-yloxy-quinazolin-4-yl]amine Formula: C22H23ClFN3O4 MolecularWeight: 447.887123

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC(=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OC4CCOCC4

Isomeric SMILES

COCCOC1=CC(=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OC4CCOCC4

InChI

InChI=1S/C22H23ClFN3O4/c1-28-8-9-30-16-11-19-21(20(12-16)31-15-4-6-29-7-5-15)22(26-13-25-19)27-14-2-3-18(24)17(23)10-14/h2-3,10-13,15H,4-9H2,1H3,(H,25,26,27)