ethyl 3-(4-butoxyphenyl)carbonyl-2-(3-chlorophenyl)-1,3-thiazolidine-4-carboxylate

Systemtic Name: ethyl 3-(4-butoxyphenyl)carbonyl-2-(3-chlorophenyl)-1,3-thiazolidine-4-carboxylate Openeye Name: ethyl 3-(4-butoxybenzoyl)-2-(3-chlorophenyl)thiazolidine-4-carboxylate CAS Name: 3-[(4-butoxyphenyl)-oxomethyl]-2-(3-chlorophenyl)-4-thiazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-butoxybenzoyl)-2-(3-chlorophenyl)-1,3-thiazolidine-4-carboxylate Traditional Name: 3-(4-butoxybenzoyl)-2-(3-chlorophenyl)thiazolidine-4-carboxylic acid ethyl ester Formula: C23H26ClNO4S MolecularWeight: 447.97484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC(=CC=C3)Cl)C(=O)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC(=CC=C3)Cl)C(=O)OCC

InChI

InChI=1S/C23H26ClNO4S/c1-3-5-13-29-19-11-9-16(10-12-19)21(26)25-20(23(27)28-4-2)15-30-22(25)17-7-6-8-18(24)14-17/h6-12,14,20,22H,3-5,13,15H2,1-2H3