2-(4-fluorophenyl)-N7-[(3-methoxyphenyl)methyl]-N4-pyridin-4-yl-quinazoline-4,7-diamine

Systemtic Name: 2-(4-fluorophenyl)-N7-[(3-methoxyphenyl)methyl]-N4-pyridin-4-yl-quinazoline-4,7-diamine Openeye Name: 2-(4-fluorophenyl)-N7-[(3-methoxyphenyl)methyl]-N4-(4-pyridyl)quinazoline-4,7-diamine CAS Name: 2-(4-fluorophenyl)-N7-[(3-methoxyphenyl)methyl]-N4-pyridin-4-ylquinazoline-4,7-diamine IUPAC Name: 2-(4-fluorophenyl)-7-N-[(3-methoxyphenyl)methyl]-4-N-pyridin-4-ylquinazoline-4,7-diamine Traditional Name: [2-(4-fluorophenyl)-7-(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)C(=NC(=N3)C4=CC=C(C=C4)F)NC5=CC=NC=C5

Isomeric SMILES

COC1=CC=CC(=C1)CNC2=CC3=C(C=C2)C(=NC(=N3)C4=CC=C(C=C4)F)NC5=CC=NC=C5

InChI

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