2-methylpropyl 3-(4-ethylphenyl)carbonyl-2-pentyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: 2-methylpropyl 3-(4-ethylphenyl)carbonyl-2-pentyl-1,3-thiazolidine-4-carboxylate Openeye Name: isobutyl 3-(4-ethylbenzoyl)-2-pentyl-thiazolidine-4-carboxylate CAS Name: 3-[(4-ethylphenyl)-oxomethyl]-2-pentyl-4-thiazolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(4-ethylbenzoyl)-2-pentyl-1,3-thiazolidine-4-carboxylate Traditional Name: 2-amyl-3-(4-ethylbenzoyl)thiazolidine-4-carboxylic acid isobutyl ester Formula: C22H33NO3S MolecularWeight: 391.56732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1N(C(CS1)C(=O)OCC(C)C)C(=O)C2=CC=C(C=C2)CC

Isomeric SMILES

CCCCCC1N(C(CS1)C(=O)OCC(C)C)C(=O)C2=CC=C(C=C2)CC

InChI

InChI=1S/C22H33NO3S/c1-5-7-8-9-20-23(19(15-27-20)22(25)26-14-16(3)4)21(24)18-12-10-17(6-2)11-13-18/h10-13,16,19-20H,5-9,14-15H2,1-4H3