6-(4-fluoranyl-3-propan-2-yloxy-phenyl)-N-[4-(1,2,4-triazol-1-yl)phenyl]quinazolin-4-amine

Systemtic Name: 6-(4-fluoranyl-3-propan-2-yloxy-phenyl)-N-[4-(1,2,4-triazol-1-yl)phenyl]quinazolin-4-amine Openeye Name: 6-(4-fluoro-3-isopropoxy-phenyl)-N-[4-(1,2,4-triazol-1-yl)phenyl]quinazolin-4-amine CAS Name: 6-(4-fluoro-3-propan-2-yloxyphenyl)-N-[4-(1,2,4-triazol-1-yl)phenyl]-4-quinazolinamine IUPAC Name: 6-(4-fluoro-3-propan-2-yloxyphenyl)-N-[4-(1,2,4-triazol-1-yl)phenyl]quinazolin-4-amine Traditional Name: [6-(4-fluoro-3-isopropoxy-phenyl)quinazolin-4-yl]-[4-(1,2,4-triazol-1-yl)phenyl]amine Formula: C25H21FN6O MolecularWeight: 440.472243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC(=C1)C2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)N5C=NC=N5)F

Isomeric SMILES

CC(C)OC1=C(C=CC(=C1)C2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)N5C=NC=N5)F

InChI

InChI=1S/C25H21FN6O/c1-16(2)33-24-12-18(3-9-22(24)26)17-4-10-23-21(11-17)25(29-14-28-23)31-19-5-7-20(8-6-19)32-15-27-13-30-32/h3-16H,1-2H3,(H,28,29,31)