N4-(3-fluoranyl-4-isoquinolin-5-yloxy-phenyl)-6-phenyl-pyrimidine-2,4-diamine

Systemtic Name: N4-(3-fluoranyl-4-isoquinolin-5-yloxy-phenyl)-6-phenyl-pyrimidine-2,4-diamine Openeye Name: N4-[3-fluoro-4-(5-isoquinolyloxy)phenyl]-6-phenyl-pyrimidine-2,4-diamine CAS Name: N4-[3-fluoro-4-(5-isoquinolinyloxy)phenyl]-6-phenylpyrimidine-2,4-diamine IUPAC Name: 4-N-(3-fluoro-4-isoquinolin-5-yloxyphenyl)-6-phenylpyrimidine-2,4-diamine Traditional Name: (2-amino-6-phenyl-pyrimidin-4-yl)-[3-fluoro-4-(5-isoquinolyloxy)phenyl]amine Formula: C25H18FN5O MolecularWeight: 423.441723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=N2)N)NC3=CC(=C(C=C3)OC4=CC=CC5=C4C=CN=C5)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=N2)N)NC3=CC(=C(C=C3)OC4=CC=CC5=C4C=CN=C5)F

InChI

InChI=1S/C25H18FN5O/c26-20-13-18(29-24-14-21(30-25(27)31-24)16-5-2-1-3-6-16)9-10-23(20)32-22-8-4-7-17-15-28-12-11-19(17)22/h1-15H,(H3,27,29,30,31)