2-chloranyl-N-[4-[(6-ethoxy-2-methyl-pyrimidin-4-yl)amino]phenyl]-4-fluoranyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-[(6-ethoxy-2-methyl-pyrimidin-4-yl)amino]phenyl]-4-fluoranyl-benzamide Openeye Name: 2-chloro-N-[4-[(6-ethoxy-2-methyl-pyrimidin-4-yl)amino]phenyl]-4-fluoro-benzamide CAS Name: 2-chloro-N-[4-[(6-ethoxy-2-methyl-4-pyrimidinyl)amino]phenyl]-4-fluorobenzamide IUPAC Name: 2-chloro-N-[4-[(6-ethoxy-2-methylpyrimidin-4-yl)amino]phenyl]-4-fluorobenzamide Traditional Name: 2-chloro-N-[4-[(6-ethoxy-2-methyl-pyrimidin-4-yl)amino]phenyl]-4-fluoro-benzamide Formula: C20H18ClFN4O2 MolecularWeight: 400.833923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC(=C1)NC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)F)Cl)C

Isomeric SMILES

CCOC1=NC(=NC(=C1)NC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)F)Cl)C

InChI

InChI=1S/C20H18ClFN4O2/c1-3-28-19-11-18(23-12(2)24-19)25-14-5-7-15(8-6-14)26-20(27)16-9-4-13(22)10-17(16)21/h4-11H,3H2,1-2H3,(H,26,27)(H,23,24,25)