6-[5-ethyl-6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]-7-fluoranyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[5-ethyl-6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]-7-fluoranyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-[5-ethyl-6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]-7-fluoro-4H-1,4-benzoxazin-3-one CAS Name: 6-[5-ethyl-6-oxo-4-(trifluoromethyl)-1-pyrimidinyl]-7-fluoro-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[5-ethyl-6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]-7-fluoro-4H-1,4-benzoxazin-3-one Traditional Name: 6-[5-ethyl-6-keto-4-(trifluoromethyl)pyrimidin-1-yl]-7-fluoro-4H-1,4-benzoxazin-3-one Formula: C15H11F4N3O3 MolecularWeight: 357.259753

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=CN(C1=O)C2=CC3=C(C=C2F)OCC(=O)N3)C(F)(F)F

Isomeric SMILES

CCC1=C(N=CN(C1=O)C2=CC3=C(C=C2F)OCC(=O)N3)C(F)(F)F

InChI

InChI=1S/C15H11F4N3O3/c1-2-7-13(15(17,18)19)20-6-22(14(7)24)10-4-9-11(3-8(10)16)25-5-12(23)21-9/h3-4,6H,2,5H2,1H3,(H,21,23)