diethyl 2-[1-[(2S,3R)-1,2-diphenyl-4-sulfanylidene-azetidin-3-yl]ethyl]propanedioate

Systemtic Name: diethyl 2-[1-[(2S,3R)-1,2-diphenyl-4-sulfanylidene-azetidin-3-yl]ethyl]propanedioate Openeye Name: diethyl 2-[1-[(2S,3R)-1,2-diphenyl-4-thioxo-azetidin-3-yl]ethyl]propanedioate CAS Name: 2-[1-[(2S,3R)-1,2-diphenyl-4-sulfanylidene-3-azetidinyl]ethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[1-[(2S,3R)-1,2-diphenyl-4-sulfanylideneazetidin-3-yl]ethyl]propanedioate Traditional Name: 2-[1-[(2S,3R)-1,2-diphenyl-4-thioxo-azetidin-3-yl]ethyl]malonic acid diethyl ester Formula: C24H27NO4S MolecularWeight: 425.54048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C1C(N(C1=S)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C24H27NO4S/c1-4-28-23(26)20(24(27)29-5-2)16(3)19-21(17-12-8-6-9-13-17)25(22(19)30)18-14-10-7-11-15-18/h6-16,19-21H,4-5H2,1-3H3/t16?,19-,21-/m1/s1