N-(3-chloranyl-4-fluoranyl-phenyl)-7-(4-morpholin-4-ylbutoxy)-6-(oxan-4-yloxy)quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-7-(4-morpholin-4-ylbutoxy)-6-(oxan-4-yloxy)quinazolin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-7-(4-morpholinobutoxy)-6-tetrahydropyran-4-yloxy-quinazolin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-7-[4-(4-morpholinyl)butoxy]-6-(4-oxanyloxy)-4-quinazolinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-7-(4-morpholin-4-ylbutoxy)-6-(oxan-4-yloxy)quinazolin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-[7-(4-morpholinobutoxy)-6-tetrahydropyran-4-yloxy-quinazolin-4-yl]amine Formula: C27H32ClFN4O4 MolecularWeight: 531.018783

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1OC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OCCCCN5CCOCC5

Isomeric SMILES

C1COCCC1OC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OCCCCN5CCOCC5

InChI

InChI=1S/C27H32ClFN4O4/c28-22-15-19(3-4-23(22)29)32-27-21-16-26(37-20-5-11-34-12-6-20)25(17-24(21)30-18-31-27)36-10-2-1-7-33-8-13-35-14-9-33/h3-4,15-18,20H,1-2,5-14H2,(H,30,31,32)