[3,4,5-triacetyloxy-6-[5-cyano-3-ethanoyl-4-(4-methoxyphenyl)-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-(4-methoxyphenyl)-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-(4-methoxyphenyl)-2-methyl-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-methyl-4H-pyridin-1-yl]-3,4,5-triacetyloxy-2-oxanyl]methyl ester IUPAC Name: [6-[3-acetyl-5-cyano-4-(4-methoxyphenyl)-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-2-mercapto-4-(4-methoxyphenyl)-6-methyl-4H-pyridin-1-yl]tetrahydropyran-2-yl]methyl ester Formula: C30H34N2O11S MolecularWeight: 630.66276

Click to see the large picture

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=C(C=C3)OC)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=C(C=C3)OC)C(=O)C

InChI

InChI=1S/C30H34N2O11S/c1-14-24(15(2)33)25(20-8-10-21(38-7)11-9-20)22(12-31)30(44)32(14)29-28(42-19(6)37)27(41-18(5)36)26(40-17(4)35)23(43-29)13-39-16(3)34/h8-11,23,25-29,44H,13H2,1-7H3