ethyl 5-cyano-2-methyl-4-naphthalen-1-yl-6-sulfanylidene-1-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-4-naphthalen-1-yl-6-sulfanylidene-1-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-4-(1-naphthyl)-6-thioxo-1-[3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-4-(1-naphthalenyl)-6-sulfanylidene-1-[3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-4-naphthalen-1-yl-6-sulfanylidene-1-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]pyridine-3-carboxylate Traditional Name: 5-cyano-2-methyl-4-(1-naphthyl)-6-thioxo-1-[3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]nicotinic acid ethyl ester Formula: C34H34N2O11S MolecularWeight: 678.70556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)C(=C1C2=CC=CC3=CC=CC=C32)C#N)C4C(C(C(C(O4)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)C(=C1C2=CC=CC3=CC=CC=C32)C#N)C4C(C(C(C(O4)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C

InChI

InChI=1S/C34H34N2O11S/c1-7-42-34(41)27-17(2)36(33(48)25(15-35)28(27)24-14-10-12-22-11-8-9-13-23(22)24)32-31(46-21(6)40)30(45-20(5)39)29(44-19(4)38)26(47-32)16-43-18(3)37/h8-14,26,29-32H,7,16H2,1-6H3