[3,4,5-triacetyloxy-6-(5-chloranylpyrimidin-2-yl)sulfanyl-oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-(5-chloranylpyrimidin-2-yl)sulfanyl-oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-(5-chloropyrimidin-2-yl)sulfanyl-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-[(5-chloro-2-pyrimidinyl)thio]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-(5-chloropyrimidin-2-yl)sulfanyloxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-[(5-chloropyrimidin-2-yl)thio]tetrahydropyran-2-yl]methyl ester Formula: C18H21ClN2O9S MolecularWeight: 476.88534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)SC2=NC=C(C=N2)Cl)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)SC2=NC=C(C=N2)Cl)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C18H21ClN2O9S/c1-8(22)26-7-13-14(27-9(2)23)15(28-10(3)24)16(29-11(4)25)17(30-13)31-18-20-5-12(19)6-21-18/h5-6,13-17H,7H2,1-4H3