[(2R,3S,5S)-3-butanoyloxy-5-(5-methyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)oxolan-2-yl]methyl butanoate

Systemtic Name: [(2R,3S,5S)-3-butanoyloxy-5-(5-methyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)oxolan-2-yl]methyl butanoate Openeye Name: [(2R,3S,5S)-3-butanoyloxy-5-(5-methyl-4-oxo-2-thioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl butanoate CAS Name: butanoic acid [(2R,3S,5S)-5-(5-methyl-4-oxo-2-sulfanylidene-1-pyrimidinyl)-3-(1-oxobutoxy)-2-oxolanyl]methyl ester IUPAC Name: [(2R,3S,5S)-3-butanoyloxy-5-(5-methyl-4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methyl butanoate Traditional Name: butyric acid [(2R,3S,5S)-3-butyryloxy-5-(4-keto-5-methyl-2-thioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C18H26N2O6S MolecularWeight: 398.47384

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC1C(CC(O1)N2C=C(C(=O)NC2=S)C)OC(=O)CCC

Isomeric SMILES

CCCC(=O)OC[C@@H]1[C@H](C[C@H](O1)N2C=C(C(=O)NC2=S)C)OC(=O)CCC

InChI

InChI=1S/C18H26N2O6S/c1-4-6-15(21)24-10-13-12(26-16(22)7-5-2)8-14(25-13)20-9-11(3)17(23)19-18(20)27/h9,12-14H,4-8,10H2,1-3H3,(H,19,23,27)/t12-,13+,14-/m0/s1