N-(3-chloranyl-4-fluoranyl-phenyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-6,7-dimethoxy-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amine Formula: C17H12ClF4N3O2 MolecularWeight: 401.742693

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12ClF4N3O2/c1-26-13-6-9-12(7-14(13)27-2)24-16(17(20,21)22)25-15(9)23-8-3-4-11(19)10(18)5-8/h3-7H,1-2H3,(H,23,24,25)