ethyl 2-(2-methoxyphenyl)-3-(4-pentylphenyl)carbonyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: ethyl 2-(2-methoxyphenyl)-3-(4-pentylphenyl)carbonyl-1,3-thiazolidine-4-carboxylate Openeye Name: ethyl 2-(2-methoxyphenyl)-3-(4-pentylbenzoyl)thiazolidine-4-carboxylate CAS Name: 2-(2-methoxyphenyl)-3-[oxo-(4-pentylphenyl)methyl]-4-thiazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-methoxyphenyl)-3-(4-pentylbenzoyl)-1,3-thiazolidine-4-carboxylate Traditional Name: 3-(4-amylbenzoyl)-2-(2-methoxyphenyl)thiazolidine-4-carboxylic acid ethyl ester Formula: C25H31NO4S MolecularWeight: 441.58294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=CC=C3OC)C(=O)OCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=CC=C3OC)C(=O)OCC

InChI

InChI=1S/C25H31NO4S/c1-4-6-7-10-18-13-15-19(16-14-18)23(27)26-21(25(28)30-5-2)17-31-24(26)20-11-8-9-12-22(20)29-3/h8-9,11-16,21,24H,4-7,10,17H2,1-3H3