3-[[5-fluoranyl-2-(pyridin-3-ylmethylamino)pyrimidin-4-yl]amino]phenol

Systemtic Name: 3-[[5-fluoranyl-2-(pyridin-3-ylmethylamino)pyrimidin-4-yl]amino]phenol Openeye Name: 3-[[5-fluoro-2-(3-pyridylmethylamino)pyrimidin-4-yl]amino]phenol CAS Name: 3-[[5-fluoro-2-(3-pyridinylmethylamino)-4-pyrimidinyl]amino]phenol IUPAC Name: 3-[[5-fluoro-2-(pyridin-3-ylmethylamino)pyrimidin-4-yl]amino]phenol Traditional Name: 3-[[5-fluoro-2-(3-pyridylmethylamino)pyrimidin-4-yl]amino]phenol Formula: C16H14FN5O MolecularWeight: 311.313663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)NC2=NC(=NC=C2F)NCC3=CN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)O)NC2=NC(=NC=C2F)NCC3=CN=CC=C3

InChI

InChI=1S/C16H14FN5O/c17-14-10-20-16(19-9-11-3-2-6-18-8-11)22-15(14)21-12-4-1-5-13(23)7-12/h1-8,10,23H,9H2,(H2,19,20,21,22)