2-[4-[[5-fluoranyl-2-[(3-hydroxyphenyl)amino]pyrimidin-4-yl]amino]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[[5-fluoranyl-2-[(3-hydroxyphenyl)amino]pyrimidin-4-yl]amino]phenoxy]ethanenitrile Openeye Name: 2-[4-[[5-fluoro-2-(3-hydroxyanilino)pyrimidin-4-yl]amino]phenoxy]acetonitrile CAS Name: 2-[4-[[5-fluoro-2-(3-hydroxyanilino)-4-pyrimidinyl]amino]phenoxy]acetonitrile IUPAC Name: 2-[4-[[5-fluoro-2-(3-hydroxyanilino)pyrimidin-4-yl]amino]phenoxy]acetonitrile Traditional Name: 2-[4-[[5-fluoro-2-(3-hydroxyanilino)pyrimidin-4-yl]amino]phenoxy]acetonitrile Formula: C18H14FN5O2 MolecularWeight: 351.334463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)NC2=NC=C(C(=N2)NC3=CC=C(C=C3)OCC#N)F

Isomeric SMILES

C1=CC(=CC(=C1)O)NC2=NC=C(C(=N2)NC3=CC=C(C=C3)OCC#N)F

InChI

InChI=1S/C18H14FN5O2/c19-16-11-21-18(23-13-2-1-3-14(25)10-13)24-17(16)22-12-4-6-15(7-5-12)26-9-8-20/h1-7,10-11,25H,9H2,(H2,21,22,23,24)