diethyl 2-[[(5-fluoranyl-6-pyridin-4-yl-pyridin-2-yl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(5-fluoranyl-6-pyridin-4-yl-pyridin-2-yl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[[[5-fluoro-6-(4-pyridyl)-2-pyridyl]amino]methylene]propanedioate CAS Name: 2-[[(5-fluoro-6-pyridin-4-yl-2-pyridinyl)amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(5-fluoro-6-pyridin-4-ylpyridin-2-yl)amino]methylidene]propanedioate Traditional Name: 2-[[[5-fluoro-6-(4-pyridyl)-2-pyridyl]amino]methylene]malonic acid diethyl ester Formula: C18H18FN3O4 MolecularWeight: 359.351623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NC(=C(C=C1)F)C2=CC=NC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=NC(=C(C=C1)F)C2=CC=NC=C2)C(=O)OCC

InChI

InChI=1S/C18H18FN3O4/c1-3-25-17(23)13(18(24)26-4-2)11-21-15-6-5-14(19)16(22-15)12-7-9-20-10-8-12/h5-11H,3-4H2,1-2H3,(H,21,22)