6-nitro-3-[[4-oxidanylidene-6-(trifluoromethyl)-5H-pyrimidin-2-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one

Systemtic Name: 6-nitro-3-[[4-oxidanylidene-6-(trifluoromethyl)-5H-pyrimidin-2-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one Openeye Name: 6-nitro-3-[[4-oxo-6-(trifluoromethyl)-5H-pyrimidin-2-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one CAS Name: 6-nitro-3-[[4-oxo-6-(trifluoromethyl)-5H-pyrimidin-2-yl]thio]-4-phenyl-1H-quinolin-2-one IUPAC Name: 6-nitro-3-[[4-oxo-6-(trifluoromethyl)-5H-pyrimidin-2-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one Traditional Name: 3-[[4-keto-6-(trifluoromethyl)-5H-pyrimidin-2-yl]thio]-6-nitro-4-phenyl-carbostyril Formula: C20H11F3N4O4S MolecularWeight: 460.38595

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC(=NC1=O)SC2=C(C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

C1C(=NC(=NC1=O)SC2=C(C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C20H11F3N4O4S/c21-20(22,23)14-9-15(28)26-19(25-14)32-17-16(10-4-2-1-3-5-10)12-8-11(27(30)31)6-7-13(12)24-18(17)29/h1-8H,9H2,(H,24,29)