4-chloranyl-5-fluoranyl-2-[3-(methylamino)-1-pyrimidin-2-yl-propoxy]benzenecarbonitrile

Systemtic Name: 4-chloranyl-5-fluoranyl-2-[3-(methylamino)-1-pyrimidin-2-yl-propoxy]benzenecarbonitrile Openeye Name: 4-chloro-5-fluoro-2-[3-(methylamino)-1-pyrimidin-2-yl-propoxy]benzonitrile CAS Name: 4-chloro-5-fluoro-2-[3-(methylamino)-1-(2-pyrimidinyl)propoxy]benzonitrile IUPAC Name: 4-chloro-5-fluoro-2-[3-(methylamino)-1-pyrimidin-2-ylpropoxy]benzonitrile Traditional Name: 4-chloro-5-fluoro-2-[3-(methylamino)-1-(2-pyrimidyl)propoxy]benzonitrile Formula: C15H14ClFN4O MolecularWeight: 320.749263

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC(C1=NC=CC=N1)OC2=CC(=C(C=C2C#N)F)Cl

Isomeric SMILES

CNCCC(C1=NC=CC=N1)OC2=CC(=C(C=C2C#N)F)Cl

InChI

InChI=1S/C15H14ClFN4O/c1-19-6-3-13(15-20-4-2-5-21-15)22-14-8-11(16)12(17)7-10(14)9-18/h2,4-5,7-8,13,19H,3,6H2,1H3