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

Systemtic Name: N6-[2-azanyl-6-(3-phenylmethoxyphenyl)pyrimidin-4-yl]-2-(4-chlorophenyl)quinoline-4,6-diamine Openeye Name: N6-[2-amino-6-(3-benzyloxyphenyl)pyrimidin-4-yl]-2-(4-chlorophenyl)quinoline-4,6-diamine CAS Name: N6-[2-amino-6-(3-phenylmethoxyphenyl)-4-pyrimidinyl]-2-(4-chlorophenyl)quinoline-4,6-diamine IUPAC Name: 6-N-[2-amino-6-(3-phenylmethoxyphenyl)pyrimidin-4-yl]-2-(4-chlorophenyl)quinoline-4,6-diamine Traditional Name: [2-amino-6-(3-benzoxyphenyl)pyrimidin-4-yl]-[4-amino-2-(4-chlorophenyl)-6-quinolyl]amine Formula: C32H25ClN6O MolecularWeight: 545.0335

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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=C(C=C6)Cl

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=C(C=C6)Cl

InChI

InChI=1S/C32H25ClN6O/c33-23-11-9-21(10-12-23)29-17-27(34)26-16-24(13-14-28(26)37-29)36-31-18-30(38-32(35)39-31)22-7-4-8-25(15-22)40-19-20-5-2-1-3-6-20/h1-18H,19H2,(H2,34,37)(H3,35,36,38,39)