2-methylpropyl (2R,4S)-3-hexanoyl-2-phenyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: 2-methylpropyl (2R,4S)-3-hexanoyl-2-phenyl-1,3-thiazolidine-4-carboxylate Openeye Name: isobutyl (2R,4S)-3-hexanoyl-2-phenyl-thiazolidine-4-carboxylate CAS Name: (2R,4S)-3-(1-oxohexyl)-2-phenyl-4-thiazolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (2R,4S)-3-hexanoyl-2-phenyl-1,3-thiazolidine-4-carboxylate Traditional Name: (2R,4S)-3-caproyl-2-phenyl-thiazolidine-4-carboxylic acid isobutyl ester Formula: C20H29NO3S MolecularWeight: 363.51416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1C(CSC1C2=CC=CC=C2)C(=O)OCC(C)C

Isomeric SMILES

CCCCCC(=O)N1[C@H](CS[C@@H]1C2=CC=CC=C2)C(=O)OCC(C)C

InChI

InChI=1S/C20H29NO3S/c1-4-5-7-12-18(22)21-17(20(23)24-13-15(2)3)14-25-19(21)16-10-8-6-9-11-16/h6,8-11,15,17,19H,4-5,7,12-14H2,1-3H3/t17-,19-/m1/s1