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

Systemtic Name: 2-[[2,3-bis(fluoranyl)phenyl]-(6-but-2-ynoxypyrimidin-4-yl)amino]ethanenitrile Openeye Name: 2-(N-(6-but-2-ynoxypyrimidin-4-yl)-2,3-difluoro-anilino)acetonitrile CAS Name: 2-(N-(6-but-2-ynoxy-4-pyrimidinyl)-2,3-difluoroanilino)acetonitrile IUPAC Name: 2-(N-(6-but-2-ynoxypyrimidin-4-yl)-2,3-difluoroanilino)acetonitrile Traditional Name: 2-(N-(6-but-2-ynoxypyrimidin-4-yl)-2,3-difluoro-anilino)acetonitrile Formula: C16H12F2N4O MolecularWeight: 314.289486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12F2N4O/c1-2-3-9-23-15-10-14(20-11-21-15)22(8-7-19)13-6-4-5-12(17)16(13)18/h4-6,10-11H,8-9H2,1H3