4-[5-chloranyl-2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-fluoranyl-2-methyl-benzenecarbonitrile

Systemtic Name: 4-[5-chloranyl-2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-fluoranyl-2-methyl-benzenecarbonitrile Openeye Name: 4-[5-chloro-2,4-dioxo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-fluoro-2-methyl-benzonitrile CAS Name: 4-[5-chloro-2,4-dioxo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-fluoro-2-methylbenzonitrile IUPAC Name: 4-[5-chloro-2,4-dioxo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-fluoro-2-methylbenzonitrile Traditional Name: 4-[5-chloro-2,4-diketo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-fluoro-2-methyl-benzonitrile Formula: C13H6ClF4N3O2 MolecularWeight: 347.652253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C#N)F)N2C(=O)C(=C(NC2=O)C(F)(F)F)Cl

Isomeric SMILES

CC1=CC(=C(C=C1C#N)F)N2C(=O)C(=C(NC2=O)C(F)(F)F)Cl

InChI

InChI=1S/C13H6ClF4N3O2/c1-5-2-8(7(15)3-6(5)4-19)21-11(22)9(14)10(13(16,17)18)20-12(21)23/h2-3H,1H3,(H,20,23)