(E)-3-[4-(3-fluoranylpropoxy)phenyl]-N-(2-pyridin-4-ylpyrimidin-4-yl)prop-2-enamide

Systemtic Name: (E)-3-[4-(3-fluoranylpropoxy)phenyl]-N-(2-pyridin-4-ylpyrimidin-4-yl)prop-2-enamide Openeye Name: (E)-3-[4-(3-fluoropropoxy)phenyl]-N-[2-(4-pyridyl)pyrimidin-4-yl]prop-2-enamide CAS Name: (E)-3-[4-(3-fluoropropoxy)phenyl]-N-(2-pyridin-4-yl-4-pyrimidinyl)-2-propenamide IUPAC Name: (E)-3-[4-(3-fluoropropoxy)phenyl]-N-(2-pyridin-4-ylpyrimidin-4-yl)prop-2-enamide Traditional Name: (E)-3-[4-(3-fluoropropoxy)phenyl]-N-[2-(4-pyridyl)pyrimidin-4-yl]acrylamide Formula: C21H19FN4O2 MolecularWeight: 378.399563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NC2=NC(=NC=C2)C3=CC=NC=C3)OCCCF

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)NC2=NC(=NC=C2)C3=CC=NC=C3)OCCCF

InChI

InChI=1S/C21H19FN4O2/c22-11-1-15-28-18-5-2-16(3-6-18)4-7-20(27)25-19-10-14-24-21(26-19)17-8-12-23-13-9-17/h2-10,12-14H,1,11,15H2,(H,24,25,26,27)/b7-4+