4-[3-azanyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoranyl-2-methoxy-benzenecarbonitrile

Systemtic Name: 4-[3-azanyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoranyl-2-methoxy-benzenecarbonitrile Openeye Name: 4-[3-amino-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-methoxy-benzonitrile CAS Name: 4-[3-amino-2,6-dioxo-4-(trifluoromethyl)-1-pyrimidinyl]-5-fluoro-2-methoxybenzonitrile IUPAC Name: 4-[3-amino-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-methoxybenzonitrile Traditional Name: 4-[3-amino-2,6-diketo-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-methoxy-benzonitrile Formula: C13H8F4N4O3 MolecularWeight: 344.221233

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C#N)F)N2C(=O)C=C(N(C2=O)N)C(F)(F)F

Isomeric SMILES

COC1=CC(=C(C=C1C#N)F)N2C(=O)C=C(N(C2=O)N)C(F)(F)F

InChI

InChI=1S/C13H8F4N4O3/c1-24-9-3-8(7(14)2-6(9)5-18)20-11(22)4-10(13(15,16)17)21(19)12(20)23/h2-4H,19H2,1H3