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

Systemtic Name: N4-(3-fluoranyl-4-isoquinolin-5-yloxy-phenyl)-6-methyl-pyrimidine-2,4-diamine Openeye Name: N4-[3-fluoro-4-(5-isoquinolyloxy)phenyl]-6-methyl-pyrimidine-2,4-diamine CAS Name: N4-[3-fluoro-4-(5-isoquinolinyloxy)phenyl]-6-methylpyrimidine-2,4-diamine IUPAC Name: 4-N-(3-fluoro-4-isoquinolin-5-yloxyphenyl)-6-methylpyrimidine-2,4-diamine Traditional Name: (2-amino-6-methyl-pyrimidin-4-yl)-[3-fluoro-4-(5-isoquinolyloxy)phenyl]amine Formula: C20H16FN5O MolecularWeight: 361.372343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N)NC2=CC(=C(C=C2)OC3=CC=CC4=C3C=CN=C4)F

Isomeric SMILES

CC1=CC(=NC(=N1)N)NC2=CC(=C(C=C2)OC3=CC=CC4=C3C=CN=C4)F

InChI

InChI=1S/C20H16FN5O/c1-12-9-19(26-20(22)24-12)25-14-5-6-18(16(21)10-14)27-17-4-2-3-13-11-23-8-7-15(13)17/h2-11H,1H3,(H3,22,24,25,26)