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

Systemtic Name: 2-methylpropyl 3-(3-methoxyphenyl)carbonyl-2-pentyl-1,3-thiazolidine-4-carboxylate Openeye Name: isobutyl 3-(3-methoxybenzoyl)-2-pentyl-thiazolidine-4-carboxylate CAS Name: 3-[(3-methoxyphenyl)-oxomethyl]-2-pentyl-4-thiazolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(3-methoxybenzoyl)-2-pentyl-1,3-thiazolidine-4-carboxylate Traditional Name: 2-amyl-3-m-anisoyl-thiazolidine-4-carboxylic acid isobutyl ester Formula: C21H31NO4S MolecularWeight: 393.54014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31NO4S/c1-5-6-7-11-19-22(18(14-27-19)21(24)26-13-15(2)3)20(23)16-9-8-10-17(12-16)25-4/h8-10,12,15,18-19H,5-7,11,13-14H2,1-4H3