7-fluoranyl-6-(1-methyl-3-oxidanylidene-5-sulfanylidene-1,2,4-triazolidin-4-yl)-4-prop-2-ynyl-1,4-benzoxazin-3-one

Systemtic Name: 7-fluoranyl-6-(1-methyl-3-oxidanylidene-5-sulfanylidene-1,2,4-triazolidin-4-yl)-4-prop-2-ynyl-1,4-benzoxazin-3-one Openeye Name: 7-fluoro-6-(1-methyl-3-oxo-5-thioxo-1,2,4-triazolidin-4-yl)-4-prop-2-ynyl-1,4-benzoxazin-3-one CAS Name: 7-fluoro-6-(1-methyl-3-oxo-5-sulfanylidene-1,2,4-triazolidin-4-yl)-4-prop-2-ynyl-1,4-benzoxazin-3-one IUPAC Name: 7-fluoro-6-(1-methyl-3-oxo-5-sulfanylidene-1,2,4-triazolidin-4-yl)-4-prop-2-ynyl-1,4-benzoxazin-3-one Traditional Name: 7-fluoro-6-(3-keto-1-methyl-5-thioxo-1,2,4-triazolidin-4-yl)-4-propargyl-1,4-benzoxazin-3-one Formula: C14H11FN4O3S MolecularWeight: 334.325543

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)N(C(=O)N1)C2=CC3=C(C=C2F)OCC(=O)N3CC#C

Isomeric SMILES

CN1C(=S)N(C(=O)N1)C2=CC3=C(C=C2F)OCC(=O)N3CC#C

InChI

InChI=1S/C14H11FN4O3S/c1-3-4-18-10-6-9(19-13(21)16-17(2)14(19)23)8(15)5-11(10)22-7-12(18)20/h1,5-6H,4,7H2,2H3,(H,16,21)