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

Systemtic Name: 3-(7-fluoranyl-3-oxidanylidene-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-1,5-dimethyl-6-sulfanylidene-1,3,5-triazinane-2,4-dione Openeye Name: 3-(7-fluoro-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-1,5-dimethyl-6-thioxo-1,3,5-triazinane-2,4-dione CAS Name: 3-(7-fluoro-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-1,5-dimethyl-6-sulfanylidene-1,3,5-triazinane-2,4-dione IUPAC Name: 3-(7-fluoro-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-1,5-dimethyl-6-sulfanylidene-1,3,5-triazinane-2,4-dione Traditional Name: 3-(7-fluoro-3-keto-4-propargyl-1,4-benzoxazin-6-yl)-1,5-dimethyl-6-thioxo-1,3,5-triazinane-2,4-quinone Formula: C16H13FN4O4S MolecularWeight: 376.362223

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(C(=O)N(C1=S)C)C2=CC3=C(C=C2F)OCC(=O)N3CC#C

Isomeric SMILES

CN1C(=O)N(C(=O)N(C1=S)C)C2=CC3=C(C=C2F)OCC(=O)N3CC#C

InChI

InChI=1S/C16H13FN4O4S/c1-4-5-20-11-7-10(9(17)6-12(11)25-8-13(20)22)21-14(23)18(2)16(26)19(3)15(21)24/h1,6-7H,5,8H2,2-3H3