ethyl (2R,3R,5S,6S)-4-ethanoyl-3,5-diphenyl-2,6-bis(phenylcarbonyl)thiane-4-carboxylate

Systemtic Name: ethyl (2R,3R,5S,6S)-4-ethanoyl-3,5-diphenyl-2,6-bis(phenylcarbonyl)thiane-4-carboxylate Openeye Name: ethyl (2R,3R,5S,6S)-4-acetyl-2,6-dibenzoyl-3,5-diphenyl-tetrahydrothiopyran-4-carboxylate CAS Name: (2R,3R,5S,6S)-4-acetyl-2,6-dibenzoyl-3,5-diphenyl-4-thianecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R,5S,6S)-4-acetyl-2,6-dibenzoyl-3,5-diphenylthiane-4-carboxylate Traditional Name: (2R,3R,5S,6S)-4-acetyl-2,6-dibenzoyl-3,5-diphenyl-tetrahydrothiopyran-4-carboxylic acid ethyl ester Formula: C36H32O5S MolecularWeight: 576.70128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(C(SC(C1C2=CC=CC=C2)C(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)C

Isomeric SMILES

CCOC(=O)C1([C@H]([C@@H](S[C@@H]([C@H]1C2=CC=CC=C2)C(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)C

InChI

InChI=1S/C36H32O5S/c1-3-41-35(40)36(24(2)37)29(25-16-8-4-9-17-25)33(31(38)27-20-12-6-13-21-27)42-34(30(36)26-18-10-5-11-19-26)32(39)28-22-14-7-15-23-28/h4-23,29-30,33-34H,3H2,1-2H3/t29-,30+,33+,34-,36?