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

Systemtic Name: 2-methylpropyl 3-(4-ethylphenyl)carbonyl-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxylate Openeye Name: isobutyl 3-(4-ethylbenzoyl)-2-isobutyl-thiazolidine-4-carboxylate CAS Name: 3-[(4-ethylphenyl)-oxomethyl]-2-(2-methylpropyl)-4-thiazolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(4-ethylbenzoyl)-2-(2-methylpropyl)-1,3-thiazolidine-4-carboxylate Traditional Name: 3-(4-ethylbenzoyl)-2-isobutyl-thiazolidine-4-carboxylic acid isobutyl ester Formula: C21H31NO3S MolecularWeight: 377.54074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2C(CSC2CC(C)C)C(=O)OCC(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2C(CSC2CC(C)C)C(=O)OCC(C)C

InChI

InChI=1S/C21H31NO3S/c1-6-16-7-9-17(10-8-16)20(23)22-18(21(24)25-12-15(4)5)13-26-19(22)11-14(2)3/h7-10,14-15,18-19H,6,11-13H2,1-5H3