ethyl (2R,3S,4R)-4-oxidanyl-2,4-diphenyl-2,3-dihydrothiochromene-3-carboxylate

Systemtic Name: ethyl (2R,3S,4R)-4-oxidanyl-2,4-diphenyl-2,3-dihydrothiochromene-3-carboxylate Openeye Name: ethyl (2R,3S,4R)-4-hydroxy-2,4-diphenyl-thiochromane-3-carboxylate CAS Name: (2R,3S,4R)-4-hydroxy-2,4-diphenyl-2,3-dihydro-1-benzothiopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2R,3S,4R)-4-hydroxy-2,4-diphenyl-2,3-dihydrothiochromene-3-carboxylate Traditional Name: (2R,3S,4R)-4-hydroxy-2,4-diphenyl-thiochroman-3-carboxylic acid ethyl ester Formula: C24H22O3S MolecularWeight: 390.49468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(SC2=CC=CC=C2C1(C3=CC=CC=C3)O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](SC2=CC=CC=C2[C@@]1(C3=CC=CC=C3)O)C4=CC=CC=C4

InChI

InChI=1S/C24H22O3S/c1-2-27-23(25)21-22(17-11-5-3-6-12-17)28-20-16-10-9-15-19(20)24(21,26)18-13-7-4-8-14-18/h3-16,21-22,26H,2H2,1H3/t21-,22+,24-/m1/s1