2-[2,3-bis(fluoranyl)phenyl]-2-(6-but-2-ynoxypyrimidin-4-yl)ethanenitrile

Systemtic Name: 2-[2,3-bis(fluoranyl)phenyl]-2-(6-but-2-ynoxypyrimidin-4-yl)ethanenitrile Openeye Name: 2-(6-but-2-ynoxypyrimidin-4-yl)-2-(2,3-difluorophenyl)acetonitrile CAS Name: 2-(6-but-2-ynoxy-4-pyrimidinyl)-2-(2,3-difluorophenyl)acetonitrile IUPAC Name: 2-(6-but-2-ynoxypyrimidin-4-yl)-2-(2,3-difluorophenyl)acetonitrile Traditional Name: 2-(6-but-2-ynoxypyrimidin-4-yl)-2-(2,3-difluorophenyl)acetonitrile Formula: C16H11F2N3O MolecularWeight: 299.274846

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=NC=NC(=C1)C(C#N)C2=C(C(=CC=C2)F)F

Isomeric SMILES

CC#CCOC1=NC=NC(=C1)C(C#N)C2=C(C(=CC=C2)F)F

InChI

InChI=1S/C16H11F2N3O/c1-2-3-7-22-15-8-14(20-10-21-15)12(9-19)11-5-4-6-13(17)16(11)18/h4-6,8,10,12H,7H2,1H3