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

Systemtic Name: 6-(1,2-dimethyl-3-oxidanylidene-5-sulfanylidene-1,2,4-triazolidin-4-yl)-7-fluoranyl-4-prop-2-ynyl-1,4-benzoxazin-3-one Openeye Name: 6-(1,2-dimethyl-3-oxo-5-thioxo-1,2,4-triazolidin-4-yl)-7-fluoro-4-prop-2-ynyl-1,4-benzoxazin-3-one CAS Name: 6-(1,2-dimethyl-3-oxo-5-sulfanylidene-1,2,4-triazolidin-4-yl)-7-fluoro-4-prop-2-ynyl-1,4-benzoxazin-3-one IUPAC Name: 6-(1,2-dimethyl-3-oxo-5-sulfanylidene-1,2,4-triazolidin-4-yl)-7-fluoro-4-prop-2-ynyl-1,4-benzoxazin-3-one Traditional Name: 7-fluoro-6-(3-keto-1,2-dimethyl-5-thioxo-1,2,4-triazolidin-4-yl)-4-propargyl-1,4-benzoxazin-3-one Formula: C15H13FN4O3S MolecularWeight: 348.352123

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(C(=S)N1C)C2=CC3=C(C=C2F)OCC(=O)N3CC#C

Isomeric SMILES

CN1C(=O)N(C(=S)N1C)C2=CC3=C(C=C2F)OCC(=O)N3CC#C

InChI

InChI=1S/C15H13FN4O3S/c1-4-5-19-11-7-10(9(16)6-12(11)23-8-13(19)21)20-14(22)17(2)18(3)15(20)24/h1,6-7H,5,8H2,2-3H3