[2-(1-adamantyl)-2-oxidanylidene-ethyl] (2R,4S)-3-ethanoyl-2-(furan-2-yl)-1,3-thiazolidine-4-carboxylate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] (2R,4S)-3-ethanoyl-2-(furan-2-yl)-1,3-thiazolidine-4-carboxylate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] (2R,4S)-3-acetyl-2-(2-furyl)thiazolidine-4-carboxylate CAS Name: (2R,4S)-3-acetyl-2-(2-furanyl)-4-thiazolidinecarboxylic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] (2R,4S)-3-acetyl-2-(furan-2-yl)-1,3-thiazolidine-4-carboxylate Traditional Name: (2R,4S)-3-acetyl-2-(2-furyl)thiazolidine-4-carboxylic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CSC1C2=CC=CO2)C(=O)OCC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(=O)N1[C@H](CS[C@@H]1C2=CC=CO2)C(=O)OCC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27NO5S/c1-13(24)23-17(12-29-20(23)18-3-2-4-27-18)21(26)28-11-19(25)22-8-14-5-15(9-22)7-16(6-14)10-22/h2-4,14-17,20H,5-12H2,1H3/t14?,15?,16?,17-,20-,22?/m1/s1