N-(3-chloranyl-4-fluoranyl-phenyl)-7-(cyclopropylmethoxy)-6-phenylmethoxy-quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-7-(cyclopropylmethoxy)-6-phenylmethoxy-quinazolin-4-amine Openeye Name: 6-benzyloxy-N-(3-chloro-4-fluoro-phenyl)-7-(cyclopropylmethoxy)quinazolin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-7-(cyclopropylmethoxy)-6-phenylmethoxy-4-quinazolinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-7-(cyclopropylmethoxy)-6-phenylmethoxyquinazolin-4-amine Traditional Name: [6-benzoxy-7-(cyclopropylmethoxy)quinazolin-4-yl]-(3-chloro-4-fluoro-phenyl)amine Formula: C25H21ClFN3O2 MolecularWeight: 449.904543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)OCC5=CC=CC=C5

Isomeric SMILES

C1CC1COC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)OCC5=CC=CC=C5

InChI

InChI=1S/C25H21ClFN3O2/c26-20-10-18(8-9-21(20)27)30-25-19-11-23(31-13-16-4-2-1-3-5-16)24(32-14-17-6-7-17)12-22(19)28-15-29-25/h1-5,8-12,15,17H,6-7,13-14H2,(H,28,29,30)