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

Systemtic Name: [3,4,5-triacetyloxy-6-[5-cyano-3-ethanoyl-4-(4-methoxyphenyl)-2-phenyl-6-sulfanyl-4H-pyridin-1-yl]oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-[3-acetyl-5-cyano-4-(4-methoxyphenyl)-2-phenyl-6-sulfanyl-4H-pyridin-1-yl]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [6-[5-acetyl-3-cyano-2-mercapto-4-(4-methoxyphenyl)-6-phenyl-4H-pyridin-1-yl]-3,4,5-triacetyloxy-2-oxanyl]methyl ester IUPAC Name: [6-[3-acetyl-5-cyano-4-(4-methoxyphenyl)-2-phenyl-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-2-mercapto-4-(4-methoxyphenyl)-6-phenyl-4H-pyridin-1-yl]tetrahydropyran-2-yl]methyl ester Formula: C35H36N2O11S MolecularWeight: 692.73214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C(=C(C1C2=CC=C(C=C2)OC)C#N)S)C3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=C(N(C(=C(C1C2=CC=C(C=C2)OC)C#N)S)C3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C35H36N2O11S/c1-18(38)28-29(23-12-14-25(43-6)15-13-23)26(16-36)35(49)37(30(28)24-10-8-7-9-11-24)34-33(47-22(5)42)32(46-21(4)41)31(45-20(3)40)27(48-34)17-44-19(2)39/h7-15,27,29,31-34,49H,17H2,1-6H3