[3,4,5-triacetyloxy-6-(3-cyano-4,6-dimethyl-2-sulfanylidene-pyridin-1-yl)oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-(3-cyano-4,6-dimethyl-2-sulfanylidene-pyridin-1-yl)oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-(3-cyano-4,6-dimethyl-2-thioxo-1-pyridyl)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-(3-cyano-4,6-dimethyl-2-sulfanylidene-1-pyridinyl)-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-(3-cyano-4,6-dimethyl-2-sulfanylidenepyridin-1-yl)oxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-(3-cyano-4,6-dimethyl-2-thioxo-1-pyridyl)tetrahydropyran-2-yl]methyl ester Formula: C22H26N2O9S MolecularWeight: 494.51484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=S)N1C2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=S)N1C2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C#N)C

InChI

InChI=1S/C22H26N2O9S/c1-10-7-11(2)24(22(34)16(10)8-23)21-20(32-15(6)28)19(31-14(5)27)18(30-13(4)26)17(33-21)9-29-12(3)25/h7,17-21H,9H2,1-6H3