N6-[2-azanyl-6-(3-chlorophenyl)pyrimidin-4-yl]-2-(4-fluorophenyl)quinoline-4,6-diamine

Systemtic Name: N6-[2-azanyl-6-(3-chlorophenyl)pyrimidin-4-yl]-2-(4-fluorophenyl)quinoline-4,6-diamine Openeye Name: N6-[2-amino-6-(3-chlorophenyl)pyrimidin-4-yl]-2-(4-fluorophenyl)quinoline-4,6-diamine CAS Name: N6-[2-amino-6-(3-chlorophenyl)-4-pyrimidinyl]-2-(4-fluorophenyl)quinoline-4,6-diamine IUPAC Name: 6-N-[2-amino-6-(3-chlorophenyl)pyrimidin-4-yl]-2-(4-fluorophenyl)quinoline-4,6-diamine Traditional Name: [2-amino-6-(3-chlorophenyl)pyrimidin-4-yl]-[4-amino-2-(4-fluorophenyl)-6-quinolyl]amine Formula: C25H18ClFN6 MolecularWeight: 456.902023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=CC(=NC(=N2)N)NC3=CC4=C(C=C3)N=C(C=C4N)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=CC(=NC(=N2)N)NC3=CC4=C(C=C3)N=C(C=C4N)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H18ClFN6/c26-16-3-1-2-15(10-16)23-13-24(33-25(29)32-23)30-18-8-9-21-19(11-18)20(28)12-22(31-21)14-4-6-17(27)7-5-14/h1-13H,(H2,28,31)(H3,29,30,32,33)