[(2R,3S,5R)-3-fluoranyl-5-(5-methyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)oxolan-2-yl]methyl 12-bromanyldodecanoate

Systemtic Name: [(2R,3S,5R)-3-fluoranyl-5-(5-methyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)oxolan-2-yl]methyl 12-bromanyldodecanoate Openeye Name: [(2R,3S,5R)-3-fluoro-5-(5-methyl-4-oxo-2-thioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl 12-bromododecanoate CAS Name: 12-bromododecanoic acid [(2R,3S,5R)-3-fluoro-5-(5-methyl-4-oxo-2-sulfanylidene-1-pyrimidinyl)-2-oxolanyl]methyl ester IUPAC Name: [(2R,3S,5R)-3-fluoro-5-(5-methyl-4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methyl 12-bromododecanoate Traditional Name: 12-bromolauric acid [(2R,3S,5R)-3-fluoro-5-(4-keto-5-methyl-2-thioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C22H34BrFN2O4S MolecularWeight: 521.483763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=S)NC1=O)C2CC(C(O2)COC(=O)CCCCCCCCCCCBr)F

Isomeric SMILES

CC1=CN(C(=S)NC1=O)[C@H]2C[C@@H]([C@H](O2)COC(=O)CCCCCCCCCCCBr)F

InChI

InChI=1S/C22H34BrFN2O4S/c1-16-14-26(22(31)25-21(16)28)19-13-17(24)18(30-19)15-29-20(27)11-9-7-5-3-2-4-6-8-10-12-23/h14,17-19H,2-13,15H2,1H3,(H,25,28,31)/t17-,18+,19+/m0/s1