methyl 5-fluoranyl-2,4-bis(oxidanylidene)-6-phenylsulfanyl-1,3-diazinane-5-carboxylate

Systemtic Name: methyl 5-fluoranyl-2,4-bis(oxidanylidene)-6-phenylsulfanyl-1,3-diazinane-5-carboxylate Openeye Name: methyl 5-fluoro-2,4-dioxo-6-phenylsulfanyl-hexahydropyrimidine-5-carboxylate CAS Name: 5-fluoro-2,4-dioxo-6-(phenylthio)-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl 5-fluoro-2,4-dioxo-6-phenylsulfanyl-1,3-diazinane-5-carboxylate Traditional Name: 5-fluoro-2,4-diketo-6-(phenylthio)hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C12H11FN2O4S MolecularWeight: 298.290143

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C(NC(=O)NC1=O)SC2=CC=CC=C2)F

Isomeric SMILES

COC(=O)C1(C(NC(=O)NC1=O)SC2=CC=CC=C2)F

InChI

InChI=1S/C12H11FN2O4S/c1-19-10(17)12(13)8(16)14-11(18)15-9(12)20-7-5-3-2-4-6-7/h2-6,9H,1H3,(H2,14,15,16,18)