2-ethyl-4-[[8-fluoranyl-5-methyl-1,1,4-tris(oxidanylidene)-2,3-dihydrothiochromen-6-yl]carbonyl]-1H-pyrazol-3-one

Systemtic Name: 2-ethyl-4-[[8-fluoranyl-5-methyl-1,1,4-tris(oxidanylidene)-2,3-dihydrothiochromen-6-yl]carbonyl]-1H-pyrazol-3-one Openeye Name: 2-ethyl-4-(8-fluoro-5-methyl-1,1,4-trioxo-2,3-dihydrothiochromene-6-carbonyl)-1H-pyrazol-3-one CAS Name: 2-ethyl-4-[(8-fluoro-5-methyl-1,1,4-trioxo-2,3-dihydro-1-benzothiopyran-6-yl)-oxomethyl]-1H-pyrazol-3-one IUPAC Name: 2-ethyl-4-(8-fluoro-5-methyl-1,1,4-trioxo-2,3-dihydrothiochromene-6-carbonyl)-1H-pyrazol-3-one Traditional Name: 2-ethyl-4-(8-fluoro-1,1,4-triketo-5-methyl-2,3-dihydrothiochromene-6-carbonyl)-3-pyrazolin-3-one Formula: C16H15FN2O5S MolecularWeight: 366.364103

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CN1)C(=O)C2=CC(=C3C(=C2C)C(=O)CCS3(=O)=O)F

Isomeric SMILES

CCN1C(=O)C(=CN1)C(=O)C2=CC(=C3C(=C2C)C(=O)CCS3(=O)=O)F

InChI

InChI=1S/C16H15FN2O5S/c1-3-19-16(22)10(7-18-19)14(21)9-6-11(17)15-13(8(9)2)12(20)4-5-25(15,23)24/h6-7,18H,3-5H2,1-2H3