N-[(Z)-(3-fluoranyl-4-methoxy-phenyl)methylideneamino]-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-[(Z)-(3-fluoranyl-4-methoxy-phenyl)methylideneamino]-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-[(Z)-(3-fluoro-4-methoxy-phenyl)methyleneamino]-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-[(Z)-(3-fluoro-4-methoxyphenyl)methylideneamino]-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-[(Z)-(3-fluoro-4-methoxyphenyl)methylideneamino]-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: [(Z)-(3-fluoro-4-methoxy-benzylidene)amino]-[2-(trifluoromethyl)quinazolin-4-yl]amine Formula: C17H12F4N4O MolecularWeight: 364.296993

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC2=NC(=NC3=CC=CC=C32)C(F)(F)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N\NC2=NC(=NC3=CC=CC=C32)C(F)(F)F)F

InChI

InChI=1S/C17H12F4N4O/c1-26-14-7-6-10(8-12(14)18)9-22-25-15-11-4-2-3-5-13(11)23-16(24-15)17(19,20)21/h2-9H,1H3,(H,23,24,25)/b22-9-