N-(3-chloranyl-4-fluoranyl-phenyl)-7-methoxy-6-[(5-methyl-1,3-dioxan-5-yl)methoxy]quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-7-methoxy-6-[(5-methyl-1,3-dioxan-5-yl)methoxy]quinazolin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-7-methoxy-6-[(5-methyl-1,3-dioxan-5-yl)methoxy]quinazolin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-7-methoxy-6-[(5-methyl-1,3-dioxan-5-yl)methoxy]-4-quinazolinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-7-methoxy-6-[(5-methyl-1,3-dioxan-5-yl)methoxy]quinazolin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-[7-methoxy-6-[(5-methyl-1,3-dioxan-5-yl)methoxy]quinazolin-4-yl]amine Formula: C21H21ClFN3O4 MolecularWeight: 433.860543

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COCOC1)COC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OC

Isomeric SMILES

CC1(COCOC1)COC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OC

InChI

InChI=1S/C21H21ClFN3O4/c1-21(8-28-12-29-9-21)10-30-19-6-14-17(7-18(19)27-2)24-11-25-20(14)26-13-3-4-16(23)15(22)5-13/h3-7,11H,8-10,12H2,1-2H3,(H,24,25,26)