[3,4,5-triacetyloxy-6-[5-cyano-3-ethanoyl-4-(furan-2-yl)-2-methyl-6-sulfanyl-4H-pyridin-1-yl]oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-[5-cyano-3-ethanoyl-4-(furan-2-yl)-2-methyl-6-sulfanyl-4H-pyridin-1-yl]oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-[3-acetyl-5-cyano-4-(2-furyl)-2-methyl-6-sulfanyl-4H-pyridin-1-yl]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [6-[5-acetyl-3-cyano-4-(2-furanyl)-2-mercapto-6-methyl-4H-pyridin-1-yl]-3,4,5-triacetyloxy-2-oxanyl]methyl ester IUPAC Name: [6-[3-acetyl-5-cyano-4-(furan-2-yl)-2-methyl-6-sulfanyl-4H-pyridin-1-yl]-3,4,5-triacetyloxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-[5-acetyl-3-cyano-4-(2-furyl)-2-mercapto-6-methyl-4H-pyridin-1-yl]tetrahydropyran-2-yl]methyl ester Formula: C27H30N2O11S MolecularWeight: 590.5989

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1C2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)S)C#N)C3=CC=CO3)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1C2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)S)C#N)C3=CC=CO3)C(=O)C

InChI

InChI=1S/C27H30N2O11S/c1-12-21(13(2)30)22(19-8-7-9-35-19)18(10-28)27(41)29(12)26-25(39-17(6)34)24(38-16(5)33)23(37-15(4)32)20(40-26)11-36-14(3)31/h7-9,20,22-26,41H,11H2,1-6H3