3-chloranyl-N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-4-fluoranyl-aniline

Systemtic Name: 3-chloranyl-N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-4-fluoranyl-aniline Openeye Name: 3-chloro-N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-4-fluoro-aniline CAS Name: 3-chloro-N-[(4,6-dimethoxy-5-pyrimidinyl)methyl]-4-fluoroaniline IUPAC Name: 3-chloro-N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-4-fluoroaniline Traditional Name: (3-chloro-4-fluoro-phenyl)-[(4,6-dimethoxypyrimidin-5-yl)methyl]amine Formula: C13H13ClFN3O2 MolecularWeight: 297.712623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NC=N1)OC)CNC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

COC1=C(C(=NC=N1)OC)CNC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C13H13ClFN3O2/c1-19-12-9(13(20-2)18-7-17-12)6-16-8-3-4-11(15)10(14)5-8/h3-5,7,16H,6H2,1-2H3