1-[5-[(5-azanyl-6-chloranyl-pyrimidin-4-yl)amino]-2-fluoranyl-phenyl]ethanone

Systemtic Name: 1-[5-[(5-azanyl-6-chloranyl-pyrimidin-4-yl)amino]-2-fluoranyl-phenyl]ethanone Openeye Name: 1-[5-[(5-amino-6-chloro-pyrimidin-4-yl)amino]-2-fluoro-phenyl]ethanone CAS Name: 1-[5-[(5-amino-6-chloro-4-pyrimidinyl)amino]-2-fluorophenyl]ethanone IUPAC Name: 1-[5-[(5-amino-6-chloropyrimidin-4-yl)amino]-2-fluorophenyl]ethanone Traditional Name: 1-[5-[(5-amino-6-chloro-pyrimidin-4-yl)amino]-2-fluoro-phenyl]ethanone Formula: C12H10ClFN4O MolecularWeight: 280.685403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)NC2=C(C(=NC=N2)Cl)N)F

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)NC2=C(C(=NC=N2)Cl)N)F

InChI

InChI=1S/C12H10ClFN4O/c1-6(19)8-4-7(2-3-9(8)14)18-12-10(15)11(13)16-5-17-12/h2-5H,15H2,1H3,(H,16,17,18)