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

Systemtic Name: N6-[2-azanyl-6-(3-phenylmethoxyphenyl)pyrimidin-4-yl]-2-(3-fluorophenyl)quinoline-4,6-diamine Openeye Name: N6-[2-amino-6-(3-benzyloxyphenyl)pyrimidin-4-yl]-2-(3-fluorophenyl)quinoline-4,6-diamine CAS Name: N6-[2-amino-6-(3-phenylmethoxyphenyl)-4-pyrimidinyl]-2-(3-fluorophenyl)quinoline-4,6-diamine IUPAC Name: 6-N-[2-amino-6-(3-phenylmethoxyphenyl)pyrimidin-4-yl]-2-(3-fluorophenyl)quinoline-4,6-diamine Traditional Name: [2-amino-6-(3-benzoxyphenyl)pyrimidin-4-yl]-[4-amino-2-(3-fluorophenyl)-6-quinolyl]amine Formula: C32H25FN6O MolecularWeight: 528.578903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C3=CC(=NC(=N3)N)NC4=CC5=C(C=C4)N=C(C=C5N)C6=CC(=CC=C6)F

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C3=CC(=NC(=N3)N)NC4=CC5=C(C=C4)N=C(C=C5N)C6=CC(=CC=C6)F

InChI

InChI=1S/C32H25FN6O/c33-23-10-4-8-21(14-23)29-17-27(34)26-16-24(12-13-28(26)37-29)36-31-18-30(38-32(35)39-31)22-9-5-11-25(15-22)40-19-20-6-2-1-3-7-20/h1-18H,19H2,(H2,34,37)(H3,35,36,38,39)