8-oxidanylidene-2-(6-oxidanylidene-1H-pyridin-3-yl)-9-[2-(trifluoromethyl)phenyl]-7H-purine-6-carboxamide

Systemtic Name: 8-oxidanylidene-2-(6-oxidanylidene-1H-pyridin-3-yl)-9-[2-(trifluoromethyl)phenyl]-7H-purine-6-carboxamide Openeye Name: 8-oxo-2-(6-oxo-1H-pyridin-3-yl)-9-[2-(trifluoromethyl)phenyl]-7H-purine-6-carboxamide CAS Name: 8-oxo-2-(6-oxo-1H-pyridin-3-yl)-9-[2-(trifluoromethyl)phenyl]-7H-purine-6-carboxamide IUPAC Name: 8-oxo-2-(6-oxo-1H-pyridin-3-yl)-9-[2-(trifluoromethyl)phenyl]-7H-purine-6-carboxamide Traditional Name: 8-keto-2-(6-keto-1H-pyridin-3-yl)-9-[2-(trifluoromethyl)phenyl]-7H-purine-6-carboxamide Formula: C18H11F3N6O3 MolecularWeight: 416.31355

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CNC(=O)C=C4

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CNC(=O)C=C4

InChI

InChI=1S/C18H11F3N6O3/c19-18(20,21)9-3-1-2-4-10(9)27-16-13(25-17(27)30)12(14(22)29)24-15(26-16)8-5-6-11(28)23-7-8/h1-7H,(H2,22,29)(H,23,28)(H,25,30)