7-[[(3R,3aS,6R,6aR)-6-fluoranyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-6-methoxy-quinazolin-4-amine

Systemtic Name: 7-[[(3R,3aS,6R,6aR)-6-fluoranyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-6-methoxy-quinazolin-4-amine Openeye Name: 7-[[(3R,3aS,6R,6aR)-6-fluoro-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-quinazolin-4-amine CAS Name: 7-[[(3R,3aS,6R,6aR)-6-fluoro-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-4-quinazolinamine IUPAC Name: 7-[[(3R,3aS,6R,6aR)-6-fluoro-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxyquinazolin-4-amine Traditional Name: [7-[[(3R,3aS,6R,6aR)-6-fluoro-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]-6-methoxy-quinazolin-4-yl]-[2-chloro-5-(trifluoromethyl)phenyl]amine Formula: C22H18ClF4N3O4 MolecularWeight: 499.842633

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=CC(=C3)C(F)(F)F)Cl)OC4COC5C4OCC5F

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=CC(=C3)C(F)(F)F)Cl)O[C@@H]4CO[C@@H]5[C@H]4OC[C@H]5F

InChI

InChI=1S/C22H18ClF4N3O4/c1-31-16-5-11-14(6-17(16)34-18-8-33-19-13(24)7-32-20(18)19)28-9-29-21(11)30-15-4-10(22(25,26)27)2-3-12(15)23/h2-6,9,13,18-20H,7-8H2,1H3,(H,28,29,30)/t13-,18-,19+,20+/m1/s1