N-(5-chloranyl-1,3-benzodioxol-4-yl)-7-fluoranyl-5-(oxan-4-yloxy)quinazolin-4-amine

Systemtic Name: N-(5-chloranyl-1,3-benzodioxol-4-yl)-7-fluoranyl-5-(oxan-4-yloxy)quinazolin-4-amine Openeye Name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-fluoro-5-tetrahydropyran-4-yloxy-quinazolin-4-amine CAS Name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-fluoro-5-(4-oxanyloxy)-4-quinazolinamine IUPAC Name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-fluoro-5-(oxan-4-yloxy)quinazolin-4-amine Traditional Name: (5-chloro-1,3-benzodioxol-4-yl)-(7-fluoro-5-tetrahydropyran-4-yloxy-quinazolin-4-yl)amine Formula: C20H17ClFN3O4 MolecularWeight: 417.818083

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1OC2=C3C(=CC(=C2)F)N=CN=C3NC4=C(C=CC5=C4OCO5)Cl

Isomeric SMILES

C1COCCC1OC2=C3C(=CC(=C2)F)N=CN=C3NC4=C(C=CC5=C4OCO5)Cl

InChI

InChI=1S/C20H17ClFN3O4/c21-13-1-2-15-19(28-10-27-15)18(13)25-20-17-14(23-9-24-20)7-11(22)8-16(17)29-12-3-5-26-6-4-12/h1-2,7-9,12H,3-6,10H2,(H,23,24,25)