7-fluoranyl-6-[4-oxidanylidene-2-sulfanylidene-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-4-prop-2-ynyl-1,4-benzoxazin-3-one

Systemtic Name: 7-fluoranyl-6-[4-oxidanylidene-2-sulfanylidene-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-4-prop-2-ynyl-1,4-benzoxazin-3-one Openeye Name: 7-fluoro-6-[4-oxo-2-thioxo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-4-prop-2-ynyl-1,4-benzoxazin-3-one CAS Name: 7-fluoro-6-[4-oxo-2-sulfanylidene-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-4-prop-2-ynyl-1,4-benzoxazin-3-one IUPAC Name: 7-fluoro-6-[4-oxo-2-sulfanylidene-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-4-prop-2-ynyl-1,4-benzoxazin-3-one Traditional Name: 7-fluoro-6-[4-keto-2-thioxo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-4-propargyl-1,4-benzoxazin-3-one Formula: C16H9F4N3O3S MolecularWeight: 399.319573

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)COC2=C1C=C(C(=C2)F)N3C(=O)C=C(NC3=S)C(F)(F)F

Isomeric SMILES

C#CCN1C(=O)COC2=C1C=C(C(=C2)F)N3C(=O)C=C(NC3=S)C(F)(F)F

InChI

InChI=1S/C16H9F4N3O3S/c1-2-3-22-10-5-9(8(17)4-11(10)26-7-14(22)25)23-13(24)6-12(16(18,19)20)21-15(23)27/h1,4-6H,3,7H2,(H,21,27)