2-(2-fluorophenyl)-N6-[(3-methoxyphenyl)methyl]-N4-pyridin-4-yl-quinazoline-4,6-diamine

Systemtic Name: 2-(2-fluorophenyl)-N6-[(3-methoxyphenyl)methyl]-N4-pyridin-4-yl-quinazoline-4,6-diamine Openeye Name: 2-(2-fluorophenyl)-N6-[(3-methoxyphenyl)methyl]-N4-(4-pyridyl)quinazoline-4,6-diamine CAS Name: 2-(2-fluorophenyl)-N6-[(3-methoxyphenyl)methyl]-N4-pyridin-4-ylquinazoline-4,6-diamine IUPAC Name: 2-(2-fluorophenyl)-6-N-[(3-methoxyphenyl)methyl]-4-N-pyridin-4-ylquinazoline-4,6-diamine Traditional Name: [2-(2-fluorophenyl)-6-(m-anisylamino)quinazolin-4-yl]-(4-pyridyl)amine Formula: C27H22FN5O MolecularWeight: 451.494883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC2=CC3=C(C=C2)N=C(N=C3NC4=CC=NC=C4)C5=CC=CC=C5F

Isomeric SMILES

COC1=CC=CC(=C1)CNC2=CC3=C(C=C2)N=C(N=C3NC4=CC=NC=C4)C5=CC=CC=C5F

InChI

InChI=1S/C27H22FN5O/c1-34-21-6-4-5-18(15-21)17-30-20-9-10-25-23(16-20)27(31-19-11-13-29-14-12-19)33-26(32-25)22-7-2-3-8-24(22)28/h2-16,30H,17H2,1H3,(H,29,31,32,33)